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Please write the SMILES representation of the molecule methyl 6-acetyloxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate . | COC(=O)C1(C)CCCC2(C)C3=CC(OC(C)=O)=C(C(C)C)C=C3CCC12 |
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Can you give the SMILES notation of the molecule 1-chloro-6-methyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole ? | CC1=CC=C2C(=C1)SC1=NN=C(Cl)N12 |
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(3,4-dibenzoyloxy-6-diethylarsanylsulfanyloxan-2-yl)methyl benzoate The above is the IUPAC name of a molecule. Write its SMILES notation. | CC[As](CC)SC1CC(OC(=O)C2=CC=CC=C2)C(OC(=O)C2=CC=CC=C2)C(COC(=O)C2=CC=CC=C2)O1 |
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What is the SMILES notation for 3-methyl-5-(6-methylhept-5-en-2-yl)spiro[3a,4,5,6,7,8a-hexahydro-1H-azulene-8,2'-oxirane]-4-ol ? | CC(C)=CCCC(C)C1CCC2(CO2)C2CC=C(C)C2C1O |
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What is the SMILES representation of the molecule with IUPAC name 1-(5-nitrofuran-2-yl)-N-propylmethanimine oxide ? | CCC[N+]([O-])=CC1=CC=C([N+](=O)[O-])O1 |
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For the molecule with 2-(tert-butylamino)-3-methylpent-2-enenitrile as the IUPAC name, what is the corresponding SMILES representation? | CCC(C)=C(C#N)NC(C)(C)C |
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Convert the IUPAC name of a molecule 4-[aziridin-1-yl-[bis(2-chloroethyl)amino]phosphoryl]oxy-3-methylbutan-2-one into SMILES representation. | CC(=O)C(C)COP(=O)(N(CCCl)CCCl)N1CC1 |
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Can you give the SMILES notation of the molecule 2-[[(3,5-dichloropyridin-2-yl)amino]methyl]phenol ? | OC1=CC=CC=C1CNC1=NC=C(Cl)C=C1Cl |
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6-amino-9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-2-one The above is the IUPAC name of a molecule. Write its SMILES notation. | NC1=C2N=CN(C3CC(O)C(CO)O3)C2=NC(=O)N1 |
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Could you provide the SMILES for N'-tert-butyl-N-(2-chlorophenyl)prop-2-enimidamide ? | C=CC(=NC(C)(C)C)NC1=CC=CC=C1Cl |
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2,12-dichloro-6,16-diethyl-10,20-dithia-4,5,7,8,14,15,17,18-octazapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3,6,8,11,13,16,18-octaene The above is the IUPAC name of a molecule. Write its SMILES notation. | CCC1=NN=C2SC3=C(Cl)C4=NN5C(CC)=NN=C5SC4=C(Cl)C3=NN12 |
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Can you tell me the SMILES representation for the molecule 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylimidazolidine-2,4,5-trione ? | COC1=CC=C(CCN2C(=O)C(=O)N(C)C2=O)C=C1OC |
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N'-[[4-(dimethylamino)phenyl]methylideneamino]-N-(furan-2-ylmethyl)oxamide is the IUPAC name of a molecule. Please give its SMILES representation. | CN(C)C1=CC=C(C=NNC(=O)C(=O)NCC2=CC=CO2)C=C1 |
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Please identify the SMILES representation of the molecule named 2-[[2-(2-aminobutanoylamino)acetyl]amino]acetic acid . | CCC(N)C(=O)NCC(=O)NCC(=O)O |
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Can you tell me the SMILES representation for the molecule N,N-diethyl-3-(4-methoxyphenyl)-2-oxo-6-phenyl-4H-1,3,2lambda5-oxazaphosphinin-2-amine ? | CCN(CC)P1(=O)OC(C2=CC=CC=C2)=CCN1C1=CC=C(OC)C=C1 |
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Please identify the SMILES representation of the molecule named 1-[[bis(4-tert-butylphenoxy)phosphinothioylhydrazinylidene]methyl]-2,3-dimethoxybenzene . | COC1=CC=CC(C=NNP(=S)(OC2=CC=C(C(C)(C)C)C=C2)OC2=CC=C(C(C)(C)C)C=C2)=C1OC |
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What is the SMILES representation for 6-amino-7H-[1,2,4]triazolo[1,5-a]pyrazin-8-one ? | NC1=CN2N=CN=C2C(=O)N1 |
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Please write the SMILES representation of the molecule 6-ethyl-3,5,6,7,8,8a-hexahydro-1H-[1,3]oxazolo[3,4-a]pyridine . | CCC1CCC2COCN2C1 |
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Can you tell me the SMILES representation for the molecule 9,10-dimethylpyrrolo[3,4-b]carbazole-1,3-dione ? | CC1=C2C(=O)NC(=O)C2=CC2=C1N(C)C1=CC=CC=C21 |
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For the molecule with 7-(dimethylamino)-4,4-bis[4-(dimethylamino)phenyl]-2,3-dihydrophthalazin-1-one as the IUPAC name, what is the corresponding SMILES representation? | CN(C)C1=CC=C(C2(C3=CC=C(N(C)C)C=C3)NNC(=O)C3=CC(N(C)C)=CC=C32)C=C1 |
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Please identify the SMILES representation of the molecule named 7-methyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene . | CC1=NC2=C(C3=C(CCCC3)S2)C2=NN=CN12 |
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Please identify the SMILES representation of the molecule named 3-amino-1-(3,4-dimethoxy-2-phenylmethoxyphenyl)-2-methylbut-2-en-1-one . | COC1=CC=C(C(=O)C(C)=C(C)N)C(OCC2=CC=CC=C2)=C1OC |
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Please identify the SMILES representation of the molecule named 3,3,6,6-tetramethylthieno[3,4-c]thiophene . | CC1(C)SC=C2C1=CSC2(C)C |
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Please identify the SMILES representation of the molecule named 2-[[6-[(4-methoxyphenyl)methyl]-1,3-benzodioxol-5-yl]oxy]ethanol . | COC1=CC=C(CC2=CC3=C(C=C2OCCO)OCO3)C=C1 |
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The IUPAC name of a certain molecule is 4-(azocan-1-yl)-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one . Can you provide its SMILES representation? | CC1=CN(C2CC(O)C(CO)O2)C(=O)N=C1N1CCCCCCC1 |
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Can you give the SMILES notation of the molecule 4-phenyl-[1,2,4]triazino[4,3-b]indazole ? | C1=CC=C(C2=CN=NC3=C4C=CC=CC4=NN23)C=C1 |
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What is the SMILES representation of the molecule with IUPAC name 2-methyl-2-[6-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-yl]propanenitrile ? | CC1=CN(C2CC3OP(=O)(C(C)(C)C#N)OCC3O2)C(=O)NC1=O |
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Can you give the SMILES notation of the molecule 3-methylsulfanyl-5-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole ? | COC1=CC(C2=NC(SC)=NN2)=CC(OC)=C1OC |
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What is the SMILES notation for 4-(3-oxo-2,6-diphenyl-1H-pyrazolo[3,4-b]pyridin-4-yl)-2,6-diphenyl-1H-pyrazolo[3,4-b]pyridin-3-one ? | O=C1C2=C(C3=CC(C4=CC=CC=C4)=NC4=C3C(=O)N(C3=CC=CC=C3)N4)C=C(C3=CC=CC=C3)N=C2NN1C1=CC=CC=C1 |
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What is the SMILES notation for 4-(7-methyloctyl)phenol ? | CC(C)CCCCCCC1=CC=C(O)C=C1 |
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For the molecule with ethyl 6,8-dihydropyrrolo[3,4-b][1,5]naphthyridine-7-carboxylate as the IUPAC name, what is the corresponding SMILES representation? | CCOC(=O)N1CC2=CC3=NC=CC=C3N=C2C1 |
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Can you tell me the SMILES representation for the molecule 1-(2-tert-butyl-5-cyclopropylpyrazol-3-yl)-3-(4-chlorophenyl)urea ? | CC(C)(C)N1N=C(C2CC2)C=C1NC(=O)NC1=CC=C(Cl)C=C1 |
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What is the SMILES notation for 4-(2-amino-6-naphthalen-2-ylpyrimidin-4-yl)-6-naphthalen-2-ylpyrimidin-2-amine ? | NC1=NC(C2=CC=C3C=CC=CC3=C2)=CC(C2=CC(C3=CC=C4C=CC=CC4=C3)=NC(N)=N2)=N1 |
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1-[(4-methoxyphenyl)methyl]-5-(methylamino)triazole-4-carboxamide The above is the IUPAC name of a molecule. Write its SMILES notation. | CNC1=C(C(N)=O)N=NN1CC1=CC=C(OC)C=C1 |
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Can you give the SMILES notation of the molecule N'-(3-chlorophenyl)-N-(2,3-dihydro-1H-benzimidazol-2-yl)methanediamine ? | ClC1=CC=CC(NCNC2NC3=CC=CC=C3N2)=C1 |
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4,5-bis[2-(4-methylphenyl)-2-oxoethyl]-2-phenyl-1,6a-dihydropyrrolo[2,3-c]pyrazol-3-one is the IUPAC name of a molecule. Please give its SMILES representation. | CC1=CC=C(C(=O)CC2=NC3NN(C4=CC=CC=C4)C(=O)C3=C2CC(=O)C2=CC=C(C)C=C2)C=C1 |
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What is the SMILES representation for 6-O-tert-butyl 5-O,7-O-dimethyl 4,5,7,8-tetrahydrofuro[3,4-d]azepine-5,6,7-tricarboxylate ? | COC(=O)C1CC2=COC=C2CC(C(=O)OC)N1C(=O)OC(C)(C)C |
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What is the SMILES representation of the molecule with IUPAC name 3-nitroso-2-phenyl-1H-indole ? | O=NC1=C(C2=CC=CC=C2)NC2=CC=CC=C12 |
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What is the SMILES representation of the molecule with IUPAC name 2-chloroethyl N-(4-methyl-9H-xanthen-9-yl)carbamate ? | CC1=CC=CC2=C1OC1=CC=CC=C1C2NC(=O)OCCCl |
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Can you tell me the SMILES representation for the molecule N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine ? | CN(C)CCN1CCCN(C)CC1 |
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What is the SMILES notation for 3-(3-cyclohexylpropyl)-4-hydroxynaphthalene-1,2-dione ? | O=C1C(=O)C2=CC=CC=C2C(O)=C1CCCC1CCCCC1 |
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Can you give the SMILES notation of the molecule 4-methoxy-N-propylbenzamide ? | CCCNC(=O)C1=CC=C(OC)C=C1 |
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Can you give the SMILES notation of the molecule 3-phenylpropyl 2-bromopropanoate ? | CC(Br)C(=O)OCCCC1=CC=CC=C1 |
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For the molecule with oxolan-2-ylmethyl 2-hydroxy-2-phenylacetate as the IUPAC name, what is the corresponding SMILES representation? | O=C(OCC1CCCO1)C(O)C1=CC=CC=C1 |
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Please identify the SMILES representation of the molecule named 4-N-[diethoxyphosphoryl-(4-methoxyphenyl)methyl]-1-N,1-N-diethylpentane-1,4-diamine . | CCOP(=O)(OCC)C(NC(C)CCCN(CC)CC)C1=CC=C(OC)C=C1 |
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Could you provide the SMILES for 2-(4-ethenylphenyl)-1,3,2-oxazaborolidine ? | C=CC1=CC=C(B2NCCO2)C=C1 |
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For the molecule with 1-bromo-2-[2-(2-bromophenyl)ethynyl]benzene as the IUPAC name, what is the corresponding SMILES representation? | BrC1=CC=CC=C1C#CC1=CC=CC=C1Br |
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The IUPAC name of a certain molecule is 2-(4-chlorophenyl)-2-(4-hydroxyiminocyclohexa-2,5-dien-1-ylidene)acetonitrile . Can you provide its SMILES representation? | N#CC(=C1C=CC(=NO)C=C1)C1=CC=C(Cl)C=C1 |
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N-propylnaphthalen-1-amine The above is the IUPAC name of a molecule. Write its SMILES notation. | CCCNC1=CC=CC2=CC=CC=C12 |
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Can you give the SMILES notation of the molecule 2-ethoxyethyl 3-(furan-2-yl)prop-2-enoate ? | CCOCCOC(=O)C=CC1=CC=CO1 |
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For the molecule with 2-hept-2-ynylpropanedioic acid as the IUPAC name, what is the corresponding SMILES representation? | CCCCC#CCC(C(=O)O)C(=O)O |
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2-methyl-2-phenylpropanehydrazide The above is the IUPAC name of a molecule. Write its SMILES notation. | CC(C)(C(=O)NN)C1=CC=CC=C1 |
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Please identify the SMILES representation of the molecule named 7-(butylamino)-4-methylchromen-2-one . | CCCCNC1=CC=C2C(C)=CC(=O)OC2=C1 |
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Could you provide the SMILES for (1,2,3,4-tetrahydronaphthalen-2-ylmethylideneamino)urea ? | NC(=O)NN=CC1CCC2=CC=CC=C2C1 |
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Please write the SMILES representation of the molecule 2-(3-oxo-1,3-diphenylpropyl)propanedioic acid . | O=C(CC(C1=CC=CC=C1)C(C(=O)O)C(=O)O)C1=CC=CC=C1 |
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Please write the SMILES representation of the molecule 1-cyclohexyl-7H-purin-6-one . | O=C1C2=C(N=CN2)N=CN1C1CCCCC1 |
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diethyl-bis(3-pyridin-4-ylpropoxy)silane is the IUPAC name of a molecule. Please give its SMILES representation. | CC[Si](CC)(OCCCC1=CC=NC=C1)OCCCC1=CC=NC=C1 |
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Convert the IUPAC name of a molecule 1-N,1-N-diethyl-4-N,4-N-bis(prop-2-enyl)benzene-1,4-diamine into SMILES representation. | C=CCN(CC=C)C1=CC=C(N(CC)CC)C=C1 |
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The IUPAC name of a certain molecule is 1-(2-methoxyphenyl)-N-[2-[(2-methoxyphenyl)methylideneamino]ethyl]methanimine . Can you provide its SMILES representation? | COC1=CC=CC=C1C=NCCN=CC1=CC=CC=C1OC |
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Convert the IUPAC name of a molecule N-[[17-[N-(dimethylamino)-C-methylcarbonimidoyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]-N-methylmethanamine into SMILES representation. | CC(=NN(C)C)C1CCC2C3CCC4=CC(=NN(C)C)CCC4(C)C3CCC12C |
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Could you provide the SMILES for N-[[17-[N-(2,4-dinitroanilino)-C-methylcarbonimidoyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]-2,4-dinitroaniline ? | CC(=NNC1=CC=C([N+](=O)[O-])C=C1[N+](=O)[O-])C1CCC2C3CCC4=CC(=NNC5=CC=C([N+](=O)[O-])C=C5[N+](=O)[O-])CCC4(C)C3CCC12C |
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What is the SMILES notation for 2-[(2,2-dichloroacetyl)amino]-3-methoxypropanoic acid ? | COCC(NC(=O)C(Cl)Cl)C(=O)O |
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4-(4-butoxy-2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-7-yl)morpholine The above is the IUPAC name of a molecule. Write its SMILES notation. | CCCCOC1=NC(N2CCOCC2)=NC2=NC(N3CCOCC3)=NC=C12 |
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For the molecule with 5-bromo-6-(2-methoxyethenyl)-1,3-benzodioxole as the IUPAC name, what is the corresponding SMILES representation? | COC=CC1=CC2=C(C=C1Br)OCO2 |
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What is the SMILES representation of the molecule with IUPAC name 5-iodo-3-methyl-2-methylsulfanyl-6-[(3,4,5-trihydroxyoxan-2-yl)amino]pyrimidin-4-one ? | CSC1=NC(NC2OCC(O)C(O)C2O)=C(I)C(=O)N1C |
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What is the SMILES representation of the molecule with IUPAC name 4-amino-1-[5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one ? | CC1=CN(C2CCC(CO)O2)C(=O)N=C1N |
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Can you give the SMILES notation of the molecule 2,3-diphenyl-1,5-dihydro-1,2,4-triazin-6-one ? | O=C1CN=C(C2=CC=CC=C2)N(C2=CC=CC=C2)N1 |
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Please identify the SMILES representation of the molecule named 1-benzyl-2-oxonaphthalene-1-carboxylic acid . | O=C(O)C1(CC2=CC=CC=C2)C(=O)C=CC2=CC=CC=C21 |
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Could you provide the SMILES for 2-(2-ethylsulfanyl-[1,3]thiazolo[5,4-d]pyrimidin-7-yl)propanedinitrile ? | CCSC1=NC2=C(C(C#N)C#N)N=CN=C2S1 |
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Can you give the SMILES notation of the molecule 4-ethoxy-3-nitropyridine ? | CCOC1=CC=NC=C1[N+](=O)[O-] |
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Please write the SMILES representation of the molecule 5-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-azido-3-(hydroxymethyl)cyclopentan-1-ol . | [N-]=[N+]=NC1C(CO)CC(N2N=NC3=C(N)N=CN=C32)C1O |
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Could you provide the SMILES for 5-(6-aminopurin-9-yl)-2-azido-3-(hydroxymethyl)cyclopentan-1-ol ? | [N-]=[N+]=NC1C(CO)CC(N2C=NC3=C(N)N=CN=C32)C1O |
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Please write the SMILES representation of the molecule 3-methyl-1-[(3-methylpyridin-1-ium-1-yl)methyl]pyridin-1-ium . | CC1=CC=C[N+](C[N+]2=CC=CC(C)=C2)=C1 |
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What is the SMILES notation for 4-methyl-6-phenylmethoxyhexanal ? | CC(CCC=O)CCOCC1=CC=CC=C1 |
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For the molecule with 2-cyano-N-[[2-(4,7-dichloro-3-hydroxy-2-oxo-1H-indol-3-yl)-1-(furan-2-yl)ethylidene]amino]acetamide as the IUPAC name, what is the corresponding SMILES representation? | N#CCC(=O)NN=C(CC1(O)C(=O)NC2=C(Cl)C=CC(Cl)=C21)C1=CC=CO1 |
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4-(2-pyridin-2-ylethenyl)thiadiazole The above is the IUPAC name of a molecule. Write its SMILES notation. | C(=CC1=CSN=N1)C1=CC=CC=N1 |
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6-oxo-2,3,3a,5-tetrahydro-1H-indene-4,4-dicarboxylic acid is the IUPAC name of a molecule. Please give its SMILES representation. | O=C1C=C2CCCC2C(C(=O)O)(C(=O)O)C1 |
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For the molecule with N-(2-ethylphenyl)-3-(2-methylpropanoyl)-2-oxoheptanamide as the IUPAC name, what is the corresponding SMILES representation? | CCCCC(C(=O)C(=O)NC1=CC=CC=C1CC)C(=O)C(C)C |
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For the molecule with 2-(5-chloro-8-hydroxy-1,4-dioxonaphthalen-2-yl)sulfanylpropanoic acid as the IUPAC name, what is the corresponding SMILES representation? | CC(SC1=CC(=O)C2=C(Cl)C=CC(O)=C2C1=O)C(=O)O |
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What is the SMILES representation of the molecule with IUPAC name 5-[(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(3-sulfophenyl)methyl]-2-hydroxy-3-methylbenzoic acid ? | CC1=CC(=C(C2=CC=CC(S(=O)(=O)O)=C2)C2=CC(C)=C(O)C(C(=O)O)=C2)C=C(C(=O)O)C1=O |
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Could you provide the SMILES for 3-hydroxy-2-methyl-2,3-dihydropyran-4-one ? | CC1OC=CC(=O)C1O |
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Can you tell me the SMILES representation for the molecule (2R,4aR)-4a-methyl-8-oxo-1,2,3,4,5,6,7,8a-octahydronaphthalene-2-carboxylic acid ? | CC12CCCC(=O)C1CC(C(=O)O)CC2 |
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2-methoxy-N-[4-[(2-methoxy-2-phenylacetyl)amino]butyl]-2-phenylacetamide is the IUPAC name of a molecule. Please give its SMILES representation. | COC(C(=O)NCCCCNC(=O)C(OC)C1=CC=CC=C1)C1=CC=CC=C1 |
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Please identify the SMILES representation of the molecule named 10-[2-(diethylamino)ethyl]-1,4-dimethoxyacridin-9-one . | CCN(CC)CCN1C2=CC=CC=C2C(=O)C2=C(OC)C=CC(OC)=C21 |
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2-iodo-4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]aniline;hydrochloride The above is the IUPAC name of a molecule. Write its SMILES notation. | Cl;NC1=CC=C(CCN2CCN(C3=CC=CC(C(F)(F)F)=C3)CC2)C=C1I |
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Can you tell me the SMILES representation for the molecule dimethyl 2-[phenyl(phenyldiazenyl)methylidene]-1,3-dithiole-4,5-dicarboxylate ? | COC(=O)C1=C(C(=O)OC)SC(=C(N=NC2=CC=CC=C2)C2=CC=CC=C2)S1 |
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N-benzyl-9H-pyrido[3,4-b]indol-6-amine;hydrochloride The above is the IUPAC name of a molecule. Write its SMILES notation. | C1=CC=C(CNC2=CC=C3NC4=CN=CC=C4C3=C2)C=C1;Cl |
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2,6-diamino-N-(3,4-dichlorophenyl)-5-phenylpyrimidine-4-carboxamide is the IUPAC name of a molecule. Please give its SMILES representation. | NC1=NC(N)=C(C2=CC=CC=C2)C(C(=O)NC2=CC=C(Cl)C(Cl)=C2)=N1 |
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N-[1-(3,4-dichlorophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide is the IUPAC name of a molecule. Please give its SMILES representation. | NNC(=O)C(=CC1=CC=C(Cl)C(Cl)=C1)NC(=O)C1=CC=CC=C1 |
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Convert the IUPAC name of a molecule N-[2-(benzenesulfonyl)-1-phenylethylidene]hydroxylamine into SMILES representation. | O=S(=O)(CC(=NO)C1=CC=CC=C1)C1=CC=CC=C1 |
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N-[1-(1-oxidopyridazin-1-ium-3-yl)ethylideneamino]benzenesulfonamide The above is the IUPAC name of a molecule. Write its SMILES notation. | CC(=NNS(=O)(=O)C1=CC=CC=C1)C1=CC=C[N+]([O-])=N1 |
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Please write the SMILES representation of the molecule benzyl 6-(methylcarbamoylamino)-2-(phenylmethoxycarbonylamino)hexanoate . | CNC(=O)NCCCCC(NC(=O)OCC1=CC=CC=C1)C(=O)OCC1=CC=CC=C1 |
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ethyl 4-[(4-methoxyphenyl)sulfonylmethyl]-3-nitrobenzoate is the IUPAC name of a molecule. Please give its SMILES representation. | CCOC(=O)C1=CC=C(CS(=O)(=O)C2=CC=C(OC)C=C2)C([N+](=O)[O-])=C1 |
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What is the SMILES representation for dioxouranium(2+);1-phenylbutane-1,3-dione ? | CC(=O)[CH-]C(=O)C1=CC=CC=C1;CC(=O)[CH-]C(=O)C1=CC=CC=C1;O=[U+2]=O |
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Could you provide the SMILES for (4-bromophenyl)methyl 3-(2-aminoethylsulfanyl)prop-2-enoate ? | NCCSC=CC(=O)OCC1=CC=C(Br)C=C1 |
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Can you give the SMILES notation of the molecule 1-[(3-chloro-2-hydroxypropyl)amino]-4-[[3-(diethylamino)-2-hydroxypropyl]amino]anthracene-9,10-dione ? | CCN(CC)CC(O)CNC1=CC=C(NCC(O)CCl)C2=C1C(=O)C1=CC=CC=C1C2=O |
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Could you provide the SMILES for 7-chloro-3a-(4-fluorophenyl)-3,4-dihydro-2H-pyrrolo[1,2-a]benzimidazol-1-one ? | O=C1CCC2(C3=CC=C(F)C=C3)NC3=CC=C(Cl)C=C3N12 |
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Can you give the SMILES notation of the molecule 3-[[[(5S,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-5-yl]amino]methyl]benzonitrile ? | COC1=CC(C2C3=CC4=C(C=C3C(NCC3=CC=CC(C#N)=C3)C3COC(=O)C23)OCO4)=CC(OC)=C1O |
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Could you provide the SMILES for N-[2-[4-[bis(2-cyanoethyl)amino]phenyl]-1-[(3-methoxyphenyl)carbamoylamino]ethenyl]-2-chloro-5-nitrobenzamide ? | COC1=CC=CC(NC(=O)NC(=CC2=CC=C(N(CCC#N)CCC#N)C=C2)NC(=O)C2=CC([N+](=O)[O-])=CC=C2Cl)=C1 |
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Please identify the SMILES representation of the molecule named 1'-methylspiro[cyclopentene-3,3'-indole]-2'-one . | CN1C(=O)C2(C=CCC2)C2=CC=CC=C21 |
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