Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoic acid [(2S)-1-oxo-1-(2-oxo-1-imidazolidinyl)propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-(2-oxidanylideneimidazolidin-1-yl)propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
MOLECULAR FORMULA: C15H18FN3O6S
MOLECULAR WEIGHT: 387.383323
SMILES: C[C@@H](C(=O)O[C@@H](C)C(=O)N1CCNC1=O)NS(=O)(=O)C2=CC=CC=C2F
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Product OPENEYE NAME: 1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
CAS Name: 1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]ethanone
IUPAC NAME: 1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethanone
SYSTEMATIC NAME: 1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
MOLECULAR FORMULA: C22H27N3OS
MOLECULAR WEIGHT: 381.53428
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCC[C@H]4[C@@H]3CCCC4
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoic acid [(2R)-1-oxo-1-(2-oxo-1-imidazolidinyl)propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-(2-oxidanylideneimidazolidin-1-yl)propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
MOLECULAR FORMULA: C15H18FN3O6S
MOLECULAR WEIGHT: 387.383323
SMILES: C[C@@H](C(=O)O[C@H](C)C(=O)N1CCNC1=O)NS(=O)(=O)C2=CC=CC=C2F
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Product OPENEYE NAME: 1-[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
CAS Name: 1-[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]ethanone
IUPAC NAME: 1-[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethanone
SYSTEMATIC NAME: 1-[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
MOLECULAR FORMULA: C22H27N3OS
MOLECULAR WEIGHT: 381.53428
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CC[C@@H]4CCCC[C@H]4C3
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Product OPENEYE NAME: [(1S)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethyl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoic acid [(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
SYSTEMATIC NAME: [(2S)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
MOLECULAR FORMULA: C15H21FN2O6S
MOLECULAR WEIGHT: 376.400443
SMILES: C[C@@H](C(=O)O[C@@H](C)C(=O)NCCOC)NS(=O)(=O)C1=CC=CC=C1F
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Product OPENEYE NAME: 1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
CAS Name: 1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]ethanone
IUPAC NAME: 1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethanone
SYSTEMATIC NAME: 1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
MOLECULAR FORMULA: C22H27N3OS
MOLECULAR WEIGHT: 381.53428
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CC[C@H]4CCCC[C@H]4C3
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Product OPENEYE NAME: 1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
CAS Name: 1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]ethanone
IUPAC NAME: 1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethanone
SYSTEMATIC NAME: 1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
MOLECULAR FORMULA: C22H27N3OS
MOLECULAR WEIGHT: 381.53428
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CC[C@@H]4CCCC[C@@H]4C3
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Product OPENEYE NAME: (4-oxo-6,7,8,9-tetrahydropyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid (4-oxo-6,7,8,9-tetrahydropyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl ester
IUPAC NAME: (4-oxo-6,7,8,9-tetrahydropyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: (4-oxidanylidene-6,7,8,9-tetrahydropyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C22H24N2O4S
MOLECULAR WEIGHT: 412.50196
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC2=CC(=O)N3C4=C(CCCC4)SC3=N2
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Product OPENEYE NAME: [(1R)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethyl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoic acid [(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
SYSTEMATIC NAME: [(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
MOLECULAR FORMULA: C15H21FN2O6S
MOLECULAR WEIGHT: 376.400443
SMILES: C[C@@H](C(=O)O[C@H](C)C(=O)NCCOC)NS(=O)(=O)C1=CC=CC=C1F
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Product OPENEYE NAME: 1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
CAS Name: 1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]ethanone
IUPAC NAME: 1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethanone
SYSTEMATIC NAME: 1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone
MOLECULAR FORMULA: C22H27N3OS
MOLECULAR WEIGHT: 381.53428
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CC[C@H]4CCCC[C@@H]4C3
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Product OPENEYE NAME: [(1S)-2-(3-fluoroanilino)-1-methyl-2-oxo-ethyl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoic acid [(2S)-1-(3-fluoroanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(3-fluoroanilino)-1-oxopropan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
SYSTEMATIC NAME: [(2S)-1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
MOLECULAR FORMULA: C18H18F2N2O5S
MOLECULAR WEIGHT: 412.407726
SMILES: C[C@@H](C(=O)O[C@@H](C)C(=O)NC1=CC(=CC=C1)F)NS(=O)(=O)C2=CC=CC=C2F
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Product OPENEYE NAME: [2-[(3,5-dichloro-2-pyridyl)amino]-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-[(3,5-dichloro-2-pyridinyl)amino]-2-oxoethyl] ester
IUPAC NAME: [2-[(3,5-dichloropyridin-2-yl)amino]-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[[3,5-bis(chloranyl)pyridin-2-yl]amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C18H18Cl2N2O4
MOLECULAR WEIGHT: 397.25252
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=C(C=C(C=N2)Cl)Cl
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Product OPENEYE NAME: N,N-diethyl-2-[methyl-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]amino]acetamide
CAS Name: N,N-diethyl-2-[methyl-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]acetamide
IUPAC NAME: N,N-diethyl-2-[methyl-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]amino]acetamide
SYSTEMATIC NAME: N,N-diethyl-2-[methyl-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]amino]ethanamide
MOLECULAR FORMULA: C20H26N4O2S
MOLECULAR WEIGHT: 386.51104
SMILES: CCN(CC)C(=O)CN(C)C(=O)CSC1=NC(=CC(=N1)C)C2=CC=CC=C2
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Product OPENEYE NAME: [2-[4-(2-methylpropanoylamino)phenyl]-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-2-oxoethyl] ester
IUPAC NAME: [2-[4-(2-methylpropanoylamino)phenyl]-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[4-(2-methylpropanoylamino)phenyl]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C23H27NO5
MOLECULAR WEIGHT: 397.46418
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C(C)C
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Product OPENEYE NAME: (2S)-N-isopropyl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2S)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-propan-2-ylpropanamide
IUPAC NAME: (2S)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-propan-2-ylpropanamide
SYSTEMATIC NAME: (2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-propan-2-yl-propanamide
MOLECULAR FORMULA: C17H21N3OS
MOLECULAR WEIGHT: 315.43314
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC(C)C
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Product OPENEYE NAME: [(1S)-1-methyl-2-[4-(2-methylpropanoylamino)phenyl]-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [(2S)-1-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[4-(2-methylpropanoylamino)phenyl]-1-oxopropan-2-yl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-[4-(2-methylpropanoylamino)phenyl]-1-oxidanylidene-propan-2-yl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C24H29NO5
MOLECULAR WEIGHT: 411.49076
SMILES: CCOC1=CC=CC=C1CCC(=O)O[C@@H](C)C(=O)C2=CC=C(C=C2)NC(=O)C(C)C
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Product OPENEYE NAME: (2R)-N-isopropyl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2R)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-propan-2-ylpropanamide
IUPAC NAME: (2R)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-propan-2-ylpropanamide
SYSTEMATIC NAME: (2R)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-propan-2-yl-propanamide
MOLECULAR FORMULA: C17H21N3OS
MOLECULAR WEIGHT: 315.43314
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@H](C)C(=O)NC(C)C
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Product OPENEYE NAME: [(1S)-2-(allylamino)-1-methyl-2-oxo-ethyl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoic acid [(2S)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-(prop-2-enylamino)propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
MOLECULAR FORMULA: C15H19FN2O5S
MOLECULAR WEIGHT: 358.385163
SMILES: C[C@@H](C(=O)O[C@@H](C)C(=O)NCC=C)NS(=O)(=O)C1=CC=CC=C1F
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Product OPENEYE NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone
IUPAC NAME: 2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
MOLECULAR FORMULA: C21H22N6OS
MOLECULAR WEIGHT: 406.50398
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCN(CC3)C4=NC=CC=N4
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Product OPENEYE NAME: [(1R)-1-methyl-2-[4-(2-methylpropanoylamino)phenyl]-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [(2R)-1-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[4-(2-methylpropanoylamino)phenyl]-1-oxopropan-2-yl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[4-(2-methylpropanoylamino)phenyl]-1-oxidanylidene-propan-2-yl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C24H29NO5
MOLECULAR WEIGHT: 411.49076
SMILES: CCOC1=CC=CC=C1CCC(=O)O[C@H](C)C(=O)C2=CC=C(C=C2)NC(=O)C(C)C
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Product OPENEYE NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethanone
IUPAC NAME: 2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone
MOLECULAR FORMULA: C22H24N5OS+
MOLECULAR WEIGHT: 406.52386
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4
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Product OPENEYE NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-1-[4-(2-pyridyl)piperazin-1-yl]ethanone
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone
IUPAC NAME: 2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
MOLECULAR FORMULA: C22H23N5OS
MOLECULAR WEIGHT: 405.51592
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCN(CC3)C4=CC=CC=N4
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Product OPENEYE NAME: [(1R)-2-(allylamino)-1-methyl-2-oxo-ethyl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoic acid [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] (2S)-2-[(2-fluorophenyl)sulfonylamino]propanoate
MOLECULAR FORMULA: C15H19FN2O5S
MOLECULAR WEIGHT: 358.385163
SMILES: C[C@@H](C(=O)O[C@H](C)C(=O)NCC=C)NS(=O)(=O)C1=CC=CC=C1F
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Product OPENEYE NAME: [2-oxo-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-oxo-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl] ester
IUPAC NAME: [2-oxo-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C22H23NO5
MOLECULAR WEIGHT: 381.42172
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)C2=CC3=C(C=C2)NC(=O)CC3
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