Product OPENEYE NAME: 2-(3-nitrophenyl)-1H-imidazole-4,5-dicarbonitrile
CAS Name: 2-(3-nitrophenyl)-1H-imidazole-4,5-dicarbonitrile
IUPAC NAME: 2-(3-nitrophenyl)-1H-imidazole-4,5-dicarbonitrile
SYSTEMATIC NAME: 2-(3-nitrophenyl)-1H-imidazole-4,5-dicarbonitrile
MOLECULAR FORMULA: C11H5N5O2
MOLECULAR WEIGHT: 239.1897
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C2=NC(=C(N2)C#N)C#N
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Product OPENEYE NAME: (E)-2-amino-3-[(4-methoxyphenyl)methyleneamino]but-2-enedinitrile
CAS Name: (E)-2-amino-3-[(4-methoxyphenyl)methylideneamino]-2-butenedinitrile
IUPAC NAME: (E)-2-amino-3-[(4-methoxyphenyl)methylideneamino]but-2-enedinitrile
SYSTEMATIC NAME: (E)-2-azanyl-3-[(4-methoxyphenyl)methylideneamino]but-2-enedinitrile
MOLECULAR FORMULA: C12H10N4O
MOLECULAR WEIGHT: 226.234
SMILES: COC1=CC=C(C=C1)C=N/C(=C(\C#N)/N)/C#N
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Product OPENEYE NAME: 4-(2-methyl-1H-imidazol-5-yl)thiazole trihydrate dihydrochloride
CAS Name: 4-(2-methyl-1H-imidazol-5-yl)thiazole trihydrate dihydrochloride
IUPAC NAME: 4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazole trihydrate dihydrochloride
SYSTEMATIC NAME: 4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazole trihydrate dihydrochloride
MOLECULAR FORMULA: C7H15Cl2N3O3S
MOLECULAR WEIGHT: 292.1833
SMILES: CC1=NC=C(N1)C2=CSC=N2.O.O.O.Cl.Cl
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Product OPENEYE NAME: 4-(2-methyl-1H-imidazol-5-yl)thiazole
CAS Name: 4-(2-methyl-1H-imidazol-5-yl)thiazole
IUPAC NAME: 4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazole
SYSTEMATIC NAME: 4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazole
MOLECULAR FORMULA: C7H7N3S
MOLECULAR WEIGHT: 165.21558
SMILES: CC1=NC=C(N1)C2=CSC=N2
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Product OPENEYE NAME: 1-ethoxypropane-1,1-diamine
CAS Name: 1-ethoxypropane-1,1-diamine
IUPAC NAME: 1-ethoxypropane-1,1-diamine
SYSTEMATIC NAME: 1-ethoxypropane-1,1-diamine
MOLECULAR FORMULA: C5H14N2O
MOLECULAR WEIGHT: 118.17746
SMILES: CCC(N)(N)OCC
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Product OPENEYE NAME: 2-azido-3-hydroxy-butanenitrile
CAS Name: 2-azido-3-hydroxybutanenitrile
IUPAC NAME: 2-azido-3-hydroxybutanenitrile
SYSTEMATIC NAME: 2-azido-3-oxidanyl-butanenitrile
MOLECULAR FORMULA: C4H6N4O
MOLECULAR WEIGHT: 126.11664
SMILES: CC(C(C#N)N=[N+]=[N-])O
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Product OPENEYE NAME: 3-hydroxy-2-(methylamino)butanenitrile
CAS Name: 3-hydroxy-2-(methylamino)butanenitrile
IUPAC NAME: 3-hydroxy-2-(methylamino)butanenitrile
SYSTEMATIC NAME: 2-(methylamino)-3-oxidanyl-butanenitrile
MOLECULAR FORMULA: C5H10N2O
MOLECULAR WEIGHT: 114.1457
SMILES: CC(C(C#N)NC)O
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Product OPENEYE NAME: 3-hydroxy-3-methyl-2-(methylamino)butanenitrile
CAS Name: 3-hydroxy-3-methyl-2-(methylamino)butanenitrile
IUPAC NAME: 3-hydroxy-3-methyl-2-(methylamino)butanenitrile
SYSTEMATIC NAME: 3-methyl-2-(methylamino)-3-oxidanyl-butanenitrile
MOLECULAR FORMULA: C6H12N2O
MOLECULAR WEIGHT: 128.17228
SMILES: CC(C)(C(C#N)NC)O
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Product OPENEYE NAME: 4,4-dibromobutan-1-ol
CAS Name: 4,4-dibromo-1-butanol
IUPAC NAME: 4,4-dibromobutan-1-ol
SYSTEMATIC NAME: 4,4-bis(bromanyl)butan-1-ol
MOLECULAR FORMULA: C4H8Br2O
MOLECULAR WEIGHT: 231.91372
SMILES: C(CC(Br)Br)CO
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Product OPENEYE NAME: 2-[benzyl(methyl)amino]-3-hydroxy-2-methyl-butanenitrile
CAS Name: 3-hydroxy-2-methyl-2-[methyl-(phenylmethyl)amino]butanenitrile
IUPAC NAME: 2-[benzyl(methyl)amino]-3-hydroxy-2-methylbutanenitrile
SYSTEMATIC NAME: 2-methyl-2-[methyl-(phenylmethyl)amino]-3-oxidanyl-butanenitrile
MOLECULAR FORMULA: C13H18N2O
MOLECULAR WEIGHT: 218.29482
SMILES: CC(C(C)(C#N)N(C)CC1=CC=CC=C1)O
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Product OPENEYE NAME: 3-hydroxy-2-methyl-2-(methylamino)butanenitrile
CAS Name: 3-hydroxy-2-methyl-2-(methylamino)butanenitrile
IUPAC NAME: 3-hydroxy-2-methyl-2-(methylamino)butanenitrile
SYSTEMATIC NAME: 2-methyl-2-(methylamino)-3-oxidanyl-butanenitrile
MOLECULAR FORMULA: C6H12N2O
MOLECULAR WEIGHT: 128.17228
SMILES: CC(C(C)(C#N)NC)O
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Product OPENEYE NAME: 2-(ethylamino)-3-hydroxy-butanenitrile
CAS Name: 2-(ethylamino)-3-hydroxybutanenitrile
IUPAC NAME: 2-(ethylamino)-3-hydroxybutanenitrile
SYSTEMATIC NAME: 2-(ethylamino)-3-oxidanyl-butanenitrile
MOLECULAR FORMULA: C6H12N2O
MOLECULAR WEIGHT: 128.17228
SMILES: CCNC(C#N)C(C)O
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Product OPENEYE NAME: 2-[benzyl(methyl)amino]-3-hydroxy-pentanenitrile
CAS Name: 3-hydroxy-2-[methyl-(phenylmethyl)amino]pentanenitrile
IUPAC NAME: 2-[benzyl(methyl)amino]-3-hydroxypentanenitrile
SYSTEMATIC NAME: 2-[methyl-(phenylmethyl)amino]-3-oxidanyl-pentanenitrile
MOLECULAR FORMULA: C13H18N2O
MOLECULAR WEIGHT: 218.29482
SMILES: CCC(C(C#N)N(C)CC1=CC=CC=C1)O
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Product OPENEYE NAME: 1-ethyl-6-fluoro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid; methanesulfonate
CAS Name: 1-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid; methanesulfonate
IUPAC NAME: 1-ethyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid; methanesulfonate
SYSTEMATIC NAME: 1-ethyl-6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid; methanesulfonate
MOLECULAR FORMULA: C17H21FN3O6S-
MOLECULAR WEIGHT: 414.428543
SMILES: CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNCC3)F)C(=O)O.CS(=O)(=O)[O-]
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Product OPENEYE NAME: pyridine-2-carboxamide hydrate
CAS Name: 2-pyridinecarboxamide hydrate
IUPAC NAME: pyridine-2-carboxamide hydrate
SYSTEMATIC NAME: pyridine-2-carboxamide hydrate
MOLECULAR FORMULA: C6H8N2O2
MOLECULAR WEIGHT: 140.13992
SMILES: C1=CC=NC(=C1)C(=O)N.O
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Product OPENEYE NAME: O1-phenyl O3-(3-thienylamino) 2-methylenepropanedioate
CAS Name: 2-methylenepropanedioic acid O1-phenyl ester O3-(3-thiophenylamino) ester
IUPAC NAME: 1-O-phenyl 3-O-(thiophen-3-ylamino) 2-methylidenepropanedioate
SYSTEMATIC NAME: O1-phenyl O3-(thiophen-3-ylamino) 2-methylidenepropanedioate
MOLECULAR FORMULA: C14H11NO4S
MOLECULAR WEIGHT: 289.30644
SMILES: C=C(C(=O)OC1=CC=CC=C1)C(=O)ONC2=CSC=C2
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Product OPENEYE NAME: 2-[(4-ethoxy-3-thienyl)amino]oxycarbonylprop-2-enoate
CAS Name: 2-[[(4-ethoxy-3-thiophenyl)amino]oxy-oxomethyl]-2-propenoate
IUPAC NAME: 2-[(4-ethoxythiophen-3-yl)amino]oxycarbonylprop-2-enoate
SYSTEMATIC NAME: 2-[(4-ethoxythiophen-3-yl)amino]oxycarbonylprop-2-enoate
MOLECULAR FORMULA: C10H10NO5S-
MOLECULAR WEIGHT: 256.2551
SMILES: CCOC1=CSC=C1NOC(=O)C(=C)C(=O)[O-]
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Product OPENEYE NAME: 2-[(4-ethoxy-3-thienyl)amino]oxycarbonylprop-2-enoic acid
CAS Name: 2-[[(4-ethoxy-3-thiophenyl)amino]oxy-oxomethyl]-2-propenoic acid
IUPAC NAME: 2-[(4-ethoxythiophen-3-yl)amino]oxycarbonylprop-2-enoic acid
SYSTEMATIC NAME: 2-[(4-ethoxythiophen-3-yl)amino]oxycarbonylprop-2-enoic acid
MOLECULAR FORMULA: C10H11NO5S
MOLECULAR WEIGHT: 257.26304
SMILES: CCOC1=CSC=C1NOC(=O)C(=C)C(=O)O
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Product OPENEYE NAME: 7-[[(2E)-2-(2-aminothiazol-4-yl)-2-ethoxyimino-acetyl]amino]-3-[[(3,4-diacetoxyphenyl)methyl-methylsulfonyl-amino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate; triethylammonium
CAS Name: 7-[[(2E)-2-(2-amino-4-thiazolyl)-2-ethoxyimino-1-oxoethyl]amino]-3-[[(3,4-diacetyloxyphenyl)methyl-methylsulfonylamino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate; triethylammonium
IUPAC NAME: 7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-ethoxyiminoacetyl]amino]-3-[[(3,4-diacetyloxyphenyl)methyl-methylsulfonylamino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate; triethylazanium
SYSTEMATIC NAME: 7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-ethoxyimino-ethanoyl]amino]-3-[[(3,4-diacetyloxyphenyl)methyl-methylsulfonyl-amino]methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate; triethylazanium
MOLECULAR FORMULA: C33H45N7O11S3
MOLECULAR WEIGHT: 811.9457
SMILES: CC[NH+](CC)CC.CCO/N=C(\C1=CSC(=N1)N)/C(=O)NC2C3N(C2=O)C(=C(CS3)CN(CC4=CC(=C(C=C4)OC(=O)C)OC(=O)C)S(=O)(=O)C)C(=O)[O-]
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