Product OPENEYE NAME: 1-naphthylmethanol
CAS Name: 1-naphthalenylmethanol
IUPAC NAME: naphthalen-1-ylmethanol
SYSTEMATIC NAME: naphthalen-1-ylmethanol
MOLECULAR FORMULA: C11H10O
MOLECULAR WEIGHT: 158.1965
SMILES: C1=CC=C2C(=C1)C=CC=C2CO
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Product OPENEYE NAME: 3-(4,6-diamino-1,3,5-triazin-2-yl)propanenitrile
CAS Name: 3-(4,6-diamino-1,3,5-triazin-2-yl)propanenitrile
IUPAC NAME: 3-(4,6-diamino-1,3,5-triazin-2-yl)propanenitrile
SYSTEMATIC NAME: 3-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]propanenitrile
MOLECULAR FORMULA: C6H8N6
MOLECULAR WEIGHT: 164.16792
SMILES: C(CC1=NC(=NC(=N1)N)N)C#N
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Product OPENEYE NAME: 2-bromobut-2-ene
CAS Name: 2-bromo-2-butene
IUPAC NAME: 2-bromobut-2-ene
SYSTEMATIC NAME: 2-bromanylbut-2-ene
MOLECULAR FORMULA: C4H7Br
MOLECULAR WEIGHT: 135.00238
SMILES: CC=C(C)Br
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Product OPENEYE NAME: (2,2,4-trimethyl-3H-benzofuran-7-yl) N-methylcarbamate
CAS Name: N-methylcarbamic acid (2,2,4-trimethyl-3H-benzofuran-7-yl) ester
IUPAC NAME: (2,2,4-trimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate
SYSTEMATIC NAME: (2,2,4-trimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate
MOLECULAR FORMULA: C13H17NO3
MOLECULAR WEIGHT: 235.27898
SMILES: CC1=C2CC(OC2=C(C=C1)OC(=O)NC)(C)C
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Product OPENEYE NAME: 3-methylbut-3-enenitrile
CAS Name: 3-methyl-3-butenenitrile
IUPAC NAME: 3-methylbut-3-enenitrile
SYSTEMATIC NAME: 3-methylbut-3-enenitrile
MOLECULAR FORMULA: C5H7N
MOLECULAR WEIGHT: 81.11578
SMILES: CC(=C)CC#N
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Product OPENEYE NAME: but-2-enenitrile
CAS Name: 2-butenenitrile
IUPAC NAME: but-2-enenitrile
SYSTEMATIC NAME: but-2-enenitrile
MOLECULAR FORMULA: C4H5N
MOLECULAR WEIGHT: 67.0892
SMILES: CC=CC#N
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Product OPENEYE NAME: 2-(4,5-dihydro-1H-imidazol-1-ium-2-ylsulfanyl)ethylammonium dibromide
CAS Name: 2-(4,5-dihydro-1H-imidazol-1-ium-2-ylthio)ethylammonium dibromide
IUPAC NAME: 2-(4,5-dihydro-1H-imidazol-1-ium-2-ylsulfanyl)ethylazanium dibromide
SYSTEMATIC NAME: 2-(4,5-dihydro-1H-imidazol-1-ium-2-ylsulfanyl)ethylazanium dibromide
MOLECULAR FORMULA: C5H13Br2N3S
MOLECULAR WEIGHT: 307.04982
SMILES: C1CN=C([NH2+]1)SCC[NH3+].[Br-].[Br-]
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Product OPENEYE NAME: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanamine
CAS Name: 2-(4,5-dihydro-1H-imidazol-2-ylthio)ethanamine
IUPAC NAME: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanamine
SYSTEMATIC NAME: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanamine
MOLECULAR FORMULA: C5H11N3S
MOLECULAR WEIGHT: 145.22594
SMILES: C1CN=C(N1)SCCN
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Product OPENEYE NAME: 3-(4,5-dihydro-1H-imidazol-1-ium-2-ylsulfanyl)propylammonium dibromide
CAS Name: 3-(4,5-dihydro-1H-imidazol-1-ium-2-ylthio)propylammonium dibromide
IUPAC NAME: 3-(4,5-dihydro-1H-imidazol-1-ium-2-ylsulfanyl)propylazanium dibromide
SYSTEMATIC NAME: 3-(4,5-dihydro-1H-imidazol-1-ium-2-ylsulfanyl)propylazanium dibromide
MOLECULAR FORMULA: C6H15Br2N3S
MOLECULAR WEIGHT: 321.0764
SMILES: C1CN=C([NH2+]1)SCCC[NH3+].[Br-].[Br-]
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Product OPENEYE NAME: 3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)propan-1-amine
CAS Name: 3-(4,5-dihydro-1H-imidazol-2-ylthio)-1-propanamine
IUPAC NAME: 3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)propan-1-amine
SYSTEMATIC NAME: 3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)propan-1-amine
MOLECULAR FORMULA: C6H13N3S
MOLECULAR WEIGHT: 159.25252
SMILES: C1CN=C(N1)SCCCN
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Product OPENEYE NAME: (17S)-3-methoxy-4,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol
CAS Name: (17S)-3-methoxy-4,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol
IUPAC NAME: (17S)-3-methoxy-4,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol
SYSTEMATIC NAME: (17S)-3-methoxy-4,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol
MOLECULAR FORMULA: C20H28O2
MOLECULAR WEIGHT: 300.43512
SMILES: CC1=C(C=CC2=C1CCC3C2CCC4(C3CC[C@@H]4O)C)OC
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Product OPENEYE NAME: 4-methyl-2-phenyl-quinoline
CAS Name: 4-methyl-2-phenylquinoline
IUPAC NAME: 4-methyl-2-phenylquinoline
SYSTEMATIC NAME: 4-methyl-2-phenyl-quinoline
MOLECULAR FORMULA: C16H13N
MOLECULAR WEIGHT: 219.28112
SMILES: CC1=CC(=NC2=CC=CC=C12)C3=CC=CC=C3
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