Product OPENEYE NAME: benzhydryl-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxo-ethyl]-methyl-ammonium
CAS Name: [2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethyl]-(diphenylmethyl)-methylammonium
IUPAC NAME: benzhydryl-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethyl]-methylazanium
SYSTEMATIC NAME: [2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethyl]-(diphenylmethyl)-methyl-azanium
MOLECULAR FORMULA: C26H28N3O2+
MOLECULAR WEIGHT: 414.51942
SMILES: CC1(C(=O)NC2=CC=CC=C2N1C(=O)C[NH+](C)C(C3=CC=CC=C3)C4=CC=CC=C4)C
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Product OPENEYE NAME: 4-[2-[benzhydryl(methyl)amino]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one
CAS Name: 4-[2-[(diphenylmethyl)-methylamino]-1-oxoethyl]-3,3-dimethyl-1H-quinoxalin-2-one
IUPAC NAME: 4-[2-[benzhydryl(methyl)amino]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one
SYSTEMATIC NAME: 4-[2-[(diphenylmethyl)-methyl-amino]ethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one
MOLECULAR FORMULA: C26H27N3O2
MOLECULAR WEIGHT: 413.51148
SMILES: CC1(C(=O)NC2=CC=CC=C2N1C(=O)CN(C)C(C3=CC=CC=C3)C4=CC=CC=C4)C
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Product OPENEYE NAME: [(1R)-2-[(3-cyano-2-thienyl)amino]-1-methyl-2-oxo-ethyl] (2R)-tetrahydrofuran-2-carboxylate
CAS Name: (2R)-2-oxolanecarboxylic acid [(2R)-1-[(3-cyano-2-thiophenyl)amino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(3-cyanothiophen-2-yl)amino]-1-oxopropan-2-yl] (2R)-oxolane-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] (2R)-oxolane-2-carboxylate
MOLECULAR FORMULA: C13H14N2O4S
MOLECULAR WEIGHT: 294.32626
SMILES: C[C@H](C(=O)NC1=C(C=CS1)C#N)OC(=O)[C@H]2CCCO2
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Product OPENEYE NAME: 1-(4-benzylpiperazin-4-ium-1-yl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethanone
IUPAC NAME: 1-(4-benzylpiperazin-4-ium-1-yl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethanone
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanone
MOLECULAR FORMULA: C24H27N4OS+
MOLECULAR WEIGHT: 419.56238
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4
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Product OPENEYE NAME: 1-(4-benzylpiperazin-1-yl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-[4-(phenylmethyl)-1-piperazinyl]ethanone
IUPAC NAME: 1-(4-benzylpiperazin-1-yl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethanone
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]ethanone
MOLECULAR FORMULA: C24H26N4OS
MOLECULAR WEIGHT: 418.55444
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCN(CC3)CC4=CC=CC=C4
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Product OPENEYE NAME: benzhydryl-[2-(4-methoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxo-ethyl]-methyl-ammonium
CAS Name: (diphenylmethyl)-[2-(4-methoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-methylammonium
IUPAC NAME: benzhydryl-[2-(4-methoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-methylazanium
SYSTEMATIC NAME: (diphenylmethyl)-[2-(4-methoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl]-methyl-azanium
MOLECULAR FORMULA: C24H27N2O3+
MOLECULAR WEIGHT: 391.48278
SMILES: CC1=C(NC(=C1C(=O)OC)C)C(=O)C[NH+](C)C(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: methyl 5-[2-[benzhydryl(methyl)amino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
CAS Name: 5-[2-[(diphenylmethyl)-methylamino]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester
IUPAC NAME: methyl 5-[2-[benzhydryl(methyl)amino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
SYSTEMATIC NAME: methyl 5-[2-[(diphenylmethyl)-methyl-amino]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
MOLECULAR FORMULA: C24H26N2O3
MOLECULAR WEIGHT: 390.47484
SMILES: CC1=C(NC(=C1C(=O)OC)C)C(=O)CN(C)C(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: [(1R)-1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [(2R)-1-(3-methylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(3-methylanilino)-1-oxopropan-2-yl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C21H19NO5
MOLECULAR WEIGHT: 365.37926
SMILES: CC1=CC(=CC=C1)NC(=O)[C@@H](C)OC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)C
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Product OPENEYE NAME: [(1S)-2-[(3-carbamoyl-2-thienyl)amino]-1-methyl-2-oxo-ethyl] (2S)-tetrahydrofuran-2-carboxylate
CAS Name: (2S)-2-oxolanecarboxylic acid [(2S)-1-[(3-carbamoyl-2-thiophenyl)amino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[(3-carbamoylthiophen-2-yl)amino]-1-oxopropan-2-yl] (2S)-oxolane-2-carboxylate
SYSTEMATIC NAME: [(2S)-1-[(3-aminocarbonylthiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] (2S)-oxolane-2-carboxylate
MOLECULAR FORMULA: C13H16N2O5S
MOLECULAR WEIGHT: 312.34154
SMILES: C[C@@H](C(=O)NC1=C(C=CS1)C(=O)N)OC(=O)[C@@H]2CCCO2
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Product OPENEYE NAME: 6-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]-4H-1,4-benzoxazin-3-one
CAS Name: 6-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]-4H-1,4-benzoxazin-3-one
IUPAC NAME: 6-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]-4H-1,4-benzoxazin-3-one
SYSTEMATIC NAME: 6-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]-4H-1,4-benzoxazin-3-one
MOLECULAR FORMULA: C21H17N3O3S
MOLECULAR WEIGHT: 391.44298
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4
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Product OPENEYE NAME: [(1S)-1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [(2S)-1-(3-methylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(3-methylanilino)-1-oxopropan-2-yl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [(2S)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C21H19NO5
MOLECULAR WEIGHT: 365.37926
SMILES: CC1=CC(=CC=C1)NC(=O)[C@H](C)OC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)C
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Product OPENEYE NAME: 1-(2-fluorophenyl)-3-[[(2S)-tetrahydrofuran-2-yl]methylcarbamothioylamino]thiourea
CAS Name: 1-[[(2-fluoroanilino)-sulfanylidenemethyl]amino]-3-[[(2S)-2-oxolanyl]methyl]thiourea
IUPAC NAME: 1-(2-fluorophenyl)-3-[[(2S)-oxolan-2-yl]methylcarbamothioylamino]thiourea
SYSTEMATIC NAME: 1-(2-fluorophenyl)-3-[[(2S)-oxolan-2-yl]methylcarbamothioylamino]thiourea
MOLECULAR FORMULA: C13H17FN4OS2
MOLECULAR WEIGHT: 328.428683
SMILES: C1C[C@H](OC1)CNC(=S)NNC(=S)NC2=CC=CC=C2F
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Product OPENEYE NAME: (3-fluorophenyl)methyl 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid (3-fluorophenyl)methyl ester
IUPAC NAME: (3-fluorophenyl)methyl 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: (3-fluorophenyl)methyl 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C18H13FO4
MOLECULAR WEIGHT: 312.291823
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)OCC3=CC(=CC=C3)F
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Product OPENEYE NAME: [(1R)-2-[(3-carbamoyl-2-thienyl)amino]-1-methyl-2-oxo-ethyl] (2S)-tetrahydrofuran-2-carboxylate
CAS Name: (2S)-2-oxolanecarboxylic acid [(2R)-1-[(3-carbamoyl-2-thiophenyl)amino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(3-carbamoylthiophen-2-yl)amino]-1-oxopropan-2-yl] (2S)-oxolane-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(3-aminocarbonylthiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] (2S)-oxolane-2-carboxylate
MOLECULAR FORMULA: C13H16N2O5S
MOLECULAR WEIGHT: 312.34154
SMILES: C[C@H](C(=O)NC1=C(C=CS1)C(=O)N)OC(=O)[C@@H]2CCCO2
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