Product OPENEYE NAME: 1-(benzenesulfonyl)-4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-4-ium
CAS Name: 1-(benzenesulfonyl)-4-[(2-chloro-6-fluorophenyl)methyl]piperazin-4-ium
IUPAC NAME: 1-(benzenesulfonyl)-4-[(2-chloro-6-fluorophenyl)methyl]piperazin-4-ium
SYSTEMATIC NAME: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(phenylsulfonyl)piperazin-1-ium
MOLECULAR FORMULA: C17H19ClFN2O2S+
MOLECULAR WEIGHT: 369.861363
SMILES: C1CN(CC[NH+]1CC2=C(C=CC=C2Cl)F)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 1-(benzenesulfonyl)-4-[(2-chloro-6-fluoro-phenyl)methyl]piperazine
CAS Name: 1-(benzenesulfonyl)-4-[(2-chloro-6-fluorophenyl)methyl]piperazine
IUPAC NAME: 1-(benzenesulfonyl)-4-[(2-chloro-6-fluorophenyl)methyl]piperazine
SYSTEMATIC NAME: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(phenylsulfonyl)piperazine
MOLECULAR FORMULA: C17H18ClFN2O2S
MOLECULAR WEIGHT: 368.853423
SMILES: C1CN(CCN1CC2=C(C=CC=C2Cl)F)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [2-(5-methoxycarbonyl-2-methyl-anilino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(5-methoxycarbonyl-2-methylanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(5-methoxycarbonyl-2-methylanilino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[(5-methoxycarbonyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C21H19NO6
MOLECULAR WEIGHT: 381.37866
SMILES: CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: 5-bromo-2-chloro-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
CAS Name: 5-bromo-2-chloro-N-[2-[(2-fluorophenyl)methylthio]ethyl]benzamide
IUPAC NAME: 5-bromo-2-chloro-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
SYSTEMATIC NAME: 5-bromanyl-2-chloranyl-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
MOLECULAR FORMULA: C16H14BrClFNOS
MOLECULAR WEIGHT: 402.708863
SMILES: C1=CC=C(C(=C1)CSCCNC(=O)C2=C(C=CC(=C2)Br)Cl)F
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Product OPENEYE NAME: (3R,7aS)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
CAS Name: (3R,7aS)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
IUPAC NAME: (3R,7aS)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
SYSTEMATIC NAME: (3R,7aS)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxidanylidene-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
MOLECULAR FORMULA: C16H20N2O2S
MOLECULAR WEIGHT: 304.4072
SMILES: CC1=C(C=C(C=C1)NC(=O)[C@@H]2CS[C@@]3(N2C(=O)CC3)C)C
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 3-(1,3-benzothiazol-2-yl)propanoate
CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [(2R)-1-oxo-1-[(1,3,5-trimethyl-4-pyrazolyl)amino]propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate
MOLECULAR FORMULA: C19H22N4O3S
MOLECULAR WEIGHT: 386.46798
SMILES: CC1=C(C(=NN1C)C)NC(=O)[C@@H](C)OC(=O)CCC2=NC3=CC=CC=C3S2
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Product OPENEYE NAME: 1-(benzenesulfonyl)-4-[(2,6-dichlorophenyl)methyl]piperazin-4-ium
CAS Name: 1-(benzenesulfonyl)-4-[(2,6-dichlorophenyl)methyl]piperazin-4-ium
IUPAC NAME: 1-(benzenesulfonyl)-4-[(2,6-dichlorophenyl)methyl]piperazin-4-ium
SYSTEMATIC NAME: 1-[[2,6-bis(chloranyl)phenyl]methyl]-4-(phenylsulfonyl)piperazin-1-ium
MOLECULAR FORMULA: C17H19Cl2N2O2S+
MOLECULAR WEIGHT: 386.31596
SMILES: C1CN(CC[NH+]1CC2=C(C=CC=C2Cl)Cl)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 1-(benzenesulfonyl)-4-[(2,6-dichlorophenyl)methyl]piperazine
CAS Name: 1-(benzenesulfonyl)-4-[(2,6-dichlorophenyl)methyl]piperazine
IUPAC NAME: 1-(benzenesulfonyl)-4-[(2,6-dichlorophenyl)methyl]piperazine
SYSTEMATIC NAME: 1-[[2,6-bis(chloranyl)phenyl]methyl]-4-(phenylsulfonyl)piperazine
MOLECULAR FORMULA: C17H18Cl2N2O2S
MOLECULAR WEIGHT: 385.30802
SMILES: C1CN(CCN1CC2=C(C=CC=C2Cl)Cl)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (3S,7aS)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
CAS Name: (3S,7aS)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
IUPAC NAME: (3S,7aS)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
SYSTEMATIC NAME: (3S,7aS)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxidanylidene-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
MOLECULAR FORMULA: C16H20N2O2S
MOLECULAR WEIGHT: 304.4072
SMILES: CC1=C(C=C(C=C1)NC(=O)[C@H]2CS[C@@]3(N2C(=O)CC3)C)C
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Product OPENEYE NAME: 1-(azepan-1-yl)-2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]ethanone
CAS Name: 1-(1-azepanyl)-2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]ethanone
IUPAC NAME: 1-(azepan-1-yl)-2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]ethanone
SYSTEMATIC NAME: 1-(azepan-1-yl)-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanone
MOLECULAR FORMULA: C18H28N3O3S+
MOLECULAR WEIGHT: 366.49822
SMILES: C1CCCN(CC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 1-(azepan-1-yl)-2-[4-(benzenesulfonyl)piperazin-1-yl]ethanone
CAS Name: 1-(1-azepanyl)-2-[4-(benzenesulfonyl)-1-piperazinyl]ethanone
IUPAC NAME: 1-(azepan-1-yl)-2-[4-(benzenesulfonyl)piperazin-1-yl]ethanone
SYSTEMATIC NAME: 1-(azepan-1-yl)-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanone
MOLECULAR FORMULA: C18H27N3O3S
MOLECULAR WEIGHT: 365.49028
SMILES: C1CCCN(CC1)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 3-(1,3-benzothiazol-2-yl)propanoate
CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [(2S)-1-oxo-1-[(1,3,5-trimethyl-4-pyrazolyl)amino]propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate
MOLECULAR FORMULA: C19H22N4O3S
MOLECULAR WEIGHT: 386.46798
SMILES: CC1=C(C(=NN1C)C)NC(=O)[C@H](C)OC(=O)CCC2=NC3=CC=CC=C3S2
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Product OPENEYE NAME: (3R,7aR)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
CAS Name: (3R,7aR)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
IUPAC NAME: (3R,7aR)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
SYSTEMATIC NAME: (3R,7aR)-N-(3,4-dimethylphenyl)-7a-methyl-5-oxidanylidene-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
MOLECULAR FORMULA: C16H20N2O2S
MOLECULAR WEIGHT: 304.4072
SMILES: CC1=C(C=C(C=C1)NC(=O)[C@@H]2CS[C@]3(N2C(=O)CC3)C)C
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Product OPENEYE NAME: [2-[2-(2,4-dioxothiazolidin-3-yl)ethylamino]-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-[2-(2,4-dioxo-3-thiazolidinyl)ethylamino]-2-oxoethyl] ester
IUPAC NAME: [2-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethylamino]-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[2-[2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethylamino]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C17H16N2O6S
MOLECULAR WEIGHT: 376.38374
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NCCN3C(=O)CSC3=O
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Product OPENEYE NAME: 3-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]propanenitrile
CAS Name: 3-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]propanenitrile
IUPAC NAME: 3-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]propanenitrile
SYSTEMATIC NAME: 3-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]propanenitrile
MOLECULAR FORMULA: C13H18N3O2S+
MOLECULAR WEIGHT: 280.36592
SMILES: C1CN(CC[NH+]1CCC#N)S(=O)(=O)C2=CC=CC=C2
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