Product OPENEYE NAME: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] 3-(2-oxopyrrolidin-1-yl)benzoate
CAS Name: 3-(2-oxo-1-pyrrolidinyl)benzoic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 3-(2-oxopyrrolidin-1-yl)benzoate
SYSTEMATIC NAME: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate
MOLECULAR FORMULA: C18H24N2O4
MOLECULAR WEIGHT: 332.39416
SMILES: CCC(C)(C)NC(=O)COC(=O)C1=CC(=CC=C1)N2CCCC2=O
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Product OPENEYE NAME: [(1R)-2-(2-fluoroanilino)-1-methyl-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [(2R)-1-(2-fluoroanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(2-fluoroanilino)-1-oxopropan-2-yl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C20H16FNO5
MOLECULAR WEIGHT: 369.343143
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)O[C@H](C)C(=O)NC3=CC=CC=C3F
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Product OPENEYE NAME: [(1R)-2-(3-acetylanilino)-1-methyl-2-oxo-ethyl]-methyl-[2-(4-methylanilino)-2-oxo-ethyl]ammonium
CAS Name: [(2R)-1-(3-acetylanilino)-1-oxopropan-2-yl]-methyl-[2-(4-methylanilino)-2-oxoethyl]ammonium
IUPAC NAME: [(2R)-1-(3-acetylanilino)-1-oxopropan-2-yl]-methyl-[2-(4-methylanilino)-2-oxoethyl]azanium
SYSTEMATIC NAME: [(2R)-1-[(3-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]azanium
MOLECULAR FORMULA: C21H26N3O3+
MOLECULAR WEIGHT: 368.44944
SMILES: CC1=CC=C(C=C1)NC(=O)C[NH+](C)[C@H](C)C(=O)NC2=CC=CC(=C2)C(=O)C
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Product OPENEYE NAME: (2R)-N-(3-acetylphenyl)-2-[methyl-[2-(4-methylanilino)-2-oxo-ethyl]amino]propanamide
CAS Name: (2R)-N-(3-acetylphenyl)-2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]propanamide
IUPAC NAME: (2R)-N-(3-acetylphenyl)-2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]propanamide
SYSTEMATIC NAME: (2R)-N-(3-ethanoylphenyl)-2-[methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]propanamide
MOLECULAR FORMULA: C21H25N3O3
MOLECULAR WEIGHT: 367.4415
SMILES: CC1=CC=C(C=C1)NC(=O)CN(C)[C@H](C)C(=O)NC2=CC=CC(=C2)C(=O)C
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Product OPENEYE NAME: [(1R)-2-[(2-chloro-3-pyridyl)amino]-1-methyl-2-oxo-ethyl] (2S)-tetrahydrofuran-2-carboxylate
CAS Name: (2S)-2-oxolanecarboxylic acid [(2R)-1-[(2-chloro-3-pyridinyl)amino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(2-chloropyridin-3-yl)amino]-1-oxopropan-2-yl] (2S)-oxolane-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(2-chloranylpyridin-3-yl)amino]-1-oxidanylidene-propan-2-yl] (2S)-oxolane-2-carboxylate
MOLECULAR FORMULA: C13H15ClN2O4
MOLECULAR WEIGHT: 298.7222
SMILES: C[C@H](C(=O)NC1=C(N=CC=C1)Cl)OC(=O)[C@@H]2CCCO2
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Product OPENEYE NAME: ethyl (6R)-2-(cyclopropylcarbamothioylamino)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
CAS Name: (6R)-2-[[(cyclopropylamino)-sulfanylidenemethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (6R)-2-(cyclopropylcarbamothioylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SYSTEMATIC NAME: ethyl (6R)-2-(cyclopropylcarbamothioylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
MOLECULAR FORMULA: C16H22N2O2S2
MOLECULAR WEIGHT: 338.48808
SMILES: CCOC(=O)C1=C(SC2=C1CC[C@H](C2)C)NC(=S)NC3CC3
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Product OPENEYE NAME: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester
IUPAC NAME: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C22H20O5
MOLECULAR WEIGHT: 364.3912
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)OCC(=O)C3=CC(=C(C=C3C)C)C
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Product OPENEYE NAME: ethyl (6S)-2-(cyclopropylcarbamothioylamino)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
CAS Name: (6S)-2-[[(cyclopropylamino)-sulfanylidenemethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (6S)-2-(cyclopropylcarbamothioylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SYSTEMATIC NAME: ethyl (6S)-2-(cyclopropylcarbamothioylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
MOLECULAR FORMULA: C16H22N2O2S2
MOLECULAR WEIGHT: 338.48808
SMILES: CCOC(=O)C1=C(SC2=C1CC[C@@H](C2)C)NC(=S)NC3CC3
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Product OPENEYE NAME: [(1S)-2-[(2-chloro-3-pyridyl)amino]-1-methyl-2-oxo-ethyl] (2R)-tetrahydrofuran-2-carboxylate
CAS Name: (2R)-2-oxolanecarboxylic acid [(2S)-1-[(2-chloro-3-pyridinyl)amino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[(2-chloropyridin-3-yl)amino]-1-oxopropan-2-yl] (2R)-oxolane-2-carboxylate
SYSTEMATIC NAME: [(2S)-1-[(2-chloranylpyridin-3-yl)amino]-1-oxidanylidene-propan-2-yl] (2R)-oxolane-2-carboxylate
MOLECULAR FORMULA: C13H15ClN2O4
MOLECULAR WEIGHT: 298.7222
SMILES: C[C@@H](C(=O)NC1=C(N=CC=C1)Cl)OC(=O)[C@H]2CCCO2
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Product OPENEYE NAME: [2-(2-benzoylanilino)-2-oxo-ethyl]-methyl-[2-(4-methylanilino)-2-oxo-ethyl]ammonium
CAS Name: [2-(2-benzoylanilino)-2-oxoethyl]-methyl-[2-(4-methylanilino)-2-oxoethyl]ammonium
IUPAC NAME: [2-(2-benzoylanilino)-2-oxoethyl]-methyl-[2-(4-methylanilino)-2-oxoethyl]azanium
SYSTEMATIC NAME: methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-[2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl]azanium
MOLECULAR FORMULA: C25H26N3O3+
MOLECULAR WEIGHT: 416.49224
SMILES: CC1=CC=C(C=C1)NC(=O)C[NH+](C)CC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[[2-(2-benzoylanilino)-2-oxo-ethyl]-methyl-amino]-N-(p-tolyl)acetamide
CAS Name: 2-[[2-(2-benzoylanilino)-2-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide
IUPAC NAME: 2-[[2-(2-benzoylanilino)-2-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide
SYSTEMATIC NAME: 2-[methyl-[2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl]amino]-N-(4-methylphenyl)ethanamide
MOLECULAR FORMULA: C25H25N3O3
MOLECULAR WEIGHT: 415.4843
SMILES: CC1=CC=C(C=C1)NC(=O)CN(C)CC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (6R)-6-methyl-2-(3-methylsulfanylpropylcarbamothioylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
CAS Name: (6R)-6-methyl-2-[[[3-(methylthio)propylamino]-sulfanylidenemethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (6R)-6-methyl-2-(3-methylsulfanylpropylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SYSTEMATIC NAME: ethyl (6R)-6-methyl-2-(3-methylsulfanylpropylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
MOLECULAR FORMULA: C17H26N2O2S3
MOLECULAR WEIGHT: 386.59554
SMILES: CCOC(=O)C1=C(SC2=C1CC[C@H](C2)C)NC(=S)NCCCSC
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Product OPENEYE NAME: [2-[(2-fluorophenyl)methylamino]-2-oxo-ethyl] 3-(2-oxopyrrolidin-1-yl)benzoate
CAS Name: 3-(2-oxo-1-pyrrolidinyl)benzoic acid [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] ester
IUPAC NAME: [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] 3-(2-oxopyrrolidin-1-yl)benzoate
SYSTEMATIC NAME: [2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate
MOLECULAR FORMULA: C20H19FN2O4
MOLECULAR WEIGHT: 370.374263
SMILES: C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)OCC(=O)NCC3=CC=CC=C3F
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Product OPENEYE NAME: [2-[N-(2-cyanoethyl)-4-methyl-anilino]-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [2-[N-(2-cyanoethyl)-4-methylanilino]-2-oxoethyl] ester
IUPAC NAME: [2-[N-(2-cyanoethyl)-4-methylanilino]-2-oxoethyl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [2-[2-cyanoethyl-(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C23H20N2O5
MOLECULAR WEIGHT: 404.4153
SMILES: CC1=CC=C(C=C1)N(CCC#N)C(=O)COC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)C
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Product OPENEYE NAME: [(1R)-2-[(2-chloro-3-pyridyl)amino]-1-methyl-2-oxo-ethyl] (2R)-tetrahydrofuran-2-carboxylate
CAS Name: (2R)-2-oxolanecarboxylic acid [(2R)-1-[(2-chloro-3-pyridinyl)amino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(2-chloropyridin-3-yl)amino]-1-oxopropan-2-yl] (2R)-oxolane-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(2-chloranylpyridin-3-yl)amino]-1-oxidanylidene-propan-2-yl] (2R)-oxolane-2-carboxylate
MOLECULAR FORMULA: C13H15ClN2O4
MOLECULAR WEIGHT: 298.7222
SMILES: C[C@H](C(=O)NC1=C(N=CC=C1)Cl)OC(=O)[C@H]2CCCO2
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Product OPENEYE NAME: ethyl (6S)-6-methyl-2-(3-methylsulfanylpropylcarbamothioylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
CAS Name: (6S)-6-methyl-2-[[[3-(methylthio)propylamino]-sulfanylidenemethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (6S)-6-methyl-2-(3-methylsulfanylpropylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SYSTEMATIC NAME: ethyl (6S)-6-methyl-2-(3-methylsulfanylpropylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
MOLECULAR FORMULA: C17H26N2O2S3
MOLECULAR WEIGHT: 386.59554
SMILES: CCOC(=O)C1=C(SC2=C1CC[C@@H](C2)C)NC(=S)NCCCSC
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Product OPENEYE NAME: [(1S)-2-(2,4-difluoroanilino)-1-methyl-2-oxo-ethyl] (2S)-tetrahydrofuran-2-carboxylate
CAS Name: (2S)-2-oxolanecarboxylic acid [(2S)-1-(2,4-difluoroanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(2,4-difluoroanilino)-1-oxopropan-2-yl] (2S)-oxolane-2-carboxylate
SYSTEMATIC NAME: [(2S)-1-[[2,4-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] (2S)-oxolane-2-carboxylate
MOLECULAR FORMULA: C14H15F2NO4
MOLECULAR WEIGHT: 299.270006
SMILES: C[C@@H](C(=O)NC1=C(C=C(C=C1)F)F)OC(=O)[C@@H]2CCCO2
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Product OPENEYE NAME: 1,3-benzothiazol-2-ylmethyl-methyl-[2-(4-methylanilino)-2-oxo-ethyl]ammonium
CAS Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-(4-methylanilino)-2-oxoethyl]ammonium
IUPAC NAME: 1,3-benzothiazol-2-ylmethyl-methyl-[2-(4-methylanilino)-2-oxoethyl]azanium
SYSTEMATIC NAME: 1,3-benzothiazol-2-ylmethyl-methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]azanium
MOLECULAR FORMULA: C18H20N3OS+
MOLECULAR WEIGHT: 326.4359
SMILES: CC1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=NC3=CC=CC=C3S2
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Product OPENEYE NAME: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(p-tolyl)acetamide
CAS Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(4-methylphenyl)acetamide
IUPAC NAME: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(4-methylphenyl)acetamide
SYSTEMATIC NAME: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(4-methylphenyl)ethanamide
MOLECULAR FORMULA: C18H19N3OS
MOLECULAR WEIGHT: 325.42796
SMILES: CC1=CC=C(C=C1)NC(=O)CN(C)CC2=NC3=CC=CC=C3S2
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