Product OPENEYE NAME: 8-nitro-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
CAS Name: 8-nitro-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide
IUPAC NAME: 8-nitro-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
SYSTEMATIC NAME: 8-nitro-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
MOLECULAR FORMULA: C22H28N3O6S+
MOLECULAR WEIGHT: 462.53922
SMILES: C1CC[NH+](CC1)CC2=CC=C(C=C2)CNS(=O)(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCCCO4
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Product OPENEYE NAME: 8-nitro-N-[[4-(1-piperidylmethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
CAS Name: 8-nitro-N-[[4-(1-piperidinylmethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide
IUPAC NAME: 8-nitro-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
SYSTEMATIC NAME: 8-nitro-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
MOLECULAR FORMULA: C22H27N3O6S
MOLECULAR WEIGHT: 461.53128
SMILES: C1CCN(CC1)CC2=CC=C(C=C2)CNS(=O)(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCCCO4
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Product OPENEYE NAME: (2R,6R)-N,2,6-trimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]morpholine-4-sulfonamide
CAS Name: (2R,6R)-N,2,6-trimethyl-N-[[2-(1-pyrrolidinyl)phenyl]methyl]-4-morpholinesulfonamide
IUPAC NAME: (2R,6R)-N,2,6-trimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]morpholine-4-sulfonamide
SYSTEMATIC NAME: (2R,6R)-N,2,6-trimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]morpholine-4-sulfonamide
MOLECULAR FORMULA: C18H29N3O3S
MOLECULAR WEIGHT: 367.50616
SMILES: C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)N(C)CC2=CC=CC=C2N3CCCC3
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Product OPENEYE NAME: (2S,6R)-N,2,6-trimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]morpholine-4-sulfonamide
CAS Name: (2S,6R)-N,2,6-trimethyl-N-[[2-(1-pyrrolidinyl)phenyl]methyl]-4-morpholinesulfonamide
IUPAC NAME: (2S,6R)-N,2,6-trimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]morpholine-4-sulfonamide
SYSTEMATIC NAME: (2S,6R)-N,2,6-trimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]morpholine-4-sulfonamide
MOLECULAR FORMULA: C18H29N3O3S
MOLECULAR WEIGHT: 367.50616
SMILES: C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)N(C)CC2=CC=CC=C2N3CCCC3
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Product OPENEYE NAME: ethyl 5-[methyl-[[4-(1-piperidyl)phenyl]methyl]sulfamoyl]-1H-pyrazole-4-carboxylate
CAS Name: 5-[methyl-[[4-(1-piperidinyl)phenyl]methyl]sulfamoyl]-1H-pyrazole-4-carboxylic acid ethyl ester
IUPAC NAME: ethyl 5-[methyl-[(4-piperidin-1-ylphenyl)methyl]sulfamoyl]-1H-pyrazole-4-carboxylate
SYSTEMATIC NAME: ethyl 5-[methyl-[(4-piperidin-1-ylphenyl)methyl]sulfamoyl]-1H-pyrazole-4-carboxylate
MOLECULAR FORMULA: C19H26N4O4S
MOLECULAR WEIGHT: 406.49914
SMILES: CCOC(=O)C1=C(NN=C1)S(=O)(=O)N(C)CC2=CC=C(C=C2)N3CCCCC3
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Product OPENEYE NAME: (4-benzyl-1-piperidyl)-(3-bromo-2,5-dimethoxy-phenyl)methanone
CAS Name: (3-bromo-2,5-dimethoxyphenyl)-[4-(phenylmethyl)-1-piperidinyl]methanone
IUPAC NAME: (4-benzylpiperidin-1-yl)-(3-bromo-2,5-dimethoxyphenyl)methanone
SYSTEMATIC NAME: (3-bromanyl-2,5-dimethoxy-phenyl)-[4-(phenylmethyl)piperidin-1-yl]methanone
MOLECULAR FORMULA: C21H24BrNO3
MOLECULAR WEIGHT: 418.32416
SMILES: COC1=CC(=C(C(=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)OC)Br
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Product OPENEYE NAME: N-(2-pyridylmethyl)-5-(2-thienyl)-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxamide
CAS Name: N-(2-pyridinylmethyl)-5-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxamide
IUPAC NAME: N-(pyridin-2-ylmethyl)-5-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxamide
SYSTEMATIC NAME: N-(pyridin-2-ylmethyl)-5-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxamide
MOLECULAR FORMULA: C20H14F3N5OS
MOLECULAR WEIGHT: 429.41827
SMILES: C1=CC=NC(=C1)CNC(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=CC(=C4)C(F)(F)F
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Product OPENEYE NAME: 3-[[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]benzenesulfonamide
CAS Name: 3-[[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]benzenesulfonamide
IUPAC NAME: 3-[[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]benzenesulfonamide
SYSTEMATIC NAME: 3-[[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]benzenesulfonamide
MOLECULAR FORMULA: C19H18N2O4S3
MOLECULAR WEIGHT: 434.55222
SMILES: C1CN([C@H](C2=C1SC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)N
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Product OPENEYE NAME: 3-[[(4R)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]benzenesulfonamide
CAS Name: 3-[[(4R)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]benzenesulfonamide
IUPAC NAME: 3-[[(4R)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]benzenesulfonamide
SYSTEMATIC NAME: 3-[[(4R)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]benzenesulfonamide
MOLECULAR FORMULA: C19H18N2O4S3
MOLECULAR WEIGHT: 434.55222
SMILES: C1CN([C@@H](C2=C1SC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)N
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Product OPENEYE NAME: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-6-methyl-pyridine-3-carboxamide
CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-6-methyl-3-pyridinecarboxamide
IUPAC NAME: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-6-methylpyridine-3-carboxamide
SYSTEMATIC NAME: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-6-methyl-pyridine-3-carboxamide
MOLECULAR FORMULA: C19H22N4OS
MOLECULAR WEIGHT: 354.46918
SMILES: CC1=NC=C(C=C1)C(=O)NC2=NN=C(S2)C34CC5CC(C3)CC(C5)C4
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Product OPENEYE NAME: (2R,6R)-N,2,6-trimethyl-N-[2-(2-methylphenoxy)ethyl]morpholine-4-sulfonamide
CAS Name: (2R,6R)-N,2,6-trimethyl-N-[2-(2-methylphenoxy)ethyl]-4-morpholinesulfonamide
IUPAC NAME: (2R,6R)-N,2,6-trimethyl-N-[2-(2-methylphenoxy)ethyl]morpholine-4-sulfonamide
SYSTEMATIC NAME: (2R,6R)-N,2,6-trimethyl-N-[2-(2-methylphenoxy)ethyl]morpholine-4-sulfonamide
MOLECULAR FORMULA: C16H26N2O4S
MOLECULAR WEIGHT: 342.45364
SMILES: C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)N(C)CCOC2=CC=CC=C2C
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Product OPENEYE NAME: (2R,6S)-N,2,6-trimethyl-N-[2-(2-methylphenoxy)ethyl]morpholine-4-sulfonamide
CAS Name: (2R,6S)-N,2,6-trimethyl-N-[2-(2-methylphenoxy)ethyl]-4-morpholinesulfonamide
IUPAC NAME: (2R,6S)-N,2,6-trimethyl-N-[2-(2-methylphenoxy)ethyl]morpholine-4-sulfonamide
SYSTEMATIC NAME: (2R,6S)-N,2,6-trimethyl-N-[2-(2-methylphenoxy)ethyl]morpholine-4-sulfonamide
MOLECULAR FORMULA: C16H26N2O4S
MOLECULAR WEIGHT: 342.45364
SMILES: C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)N(C)CCOC2=CC=CC=C2C
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Product OPENEYE NAME: 1-(p-tolylsulfonyl)-4-[2-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepane
CAS Name: 1-(4-methylphenyl)sulfonyl-4-[2-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepane
IUPAC NAME: 1-(4-methylphenyl)sulfonyl-4-[2-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepane
SYSTEMATIC NAME: 1-(4-methylphenyl)sulfonyl-4-[2-(trifluoromethyloxy)phenyl]sulfonyl-1,4-diazepane
MOLECULAR FORMULA: C19H21F3N2O5S2
MOLECULAR WEIGHT: 478.50565
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=CC=C3OC(F)(F)F
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Product OPENEYE NAME: methyl 5-[[[5-(furan-2-carbonylamino)thiophene-2-carbonyl]amino]methyl]-2-methoxy-benzoate
CAS Name: 5-[[[[5-[[2-furanyl(oxo)methyl]amino]-2-thiophenyl]-oxomethyl]amino]methyl]-2-methoxybenzoic acid methyl ester
IUPAC NAME: methyl 5-[[[5-(furan-2-carbonylamino)thiophene-2-carbonyl]amino]methyl]-2-methoxybenzoate
SYSTEMATIC NAME: methyl 5-[[[5-(furan-2-ylcarbonylamino)thiophen-2-yl]carbonylamino]methyl]-2-methoxy-benzoate
MOLECULAR FORMULA: C20H18N2O6S
MOLECULAR WEIGHT: 414.43172
SMILES: COC1=C(C=C(C=C1)CNC(=O)C2=CC=C(S2)NC(=O)C3=CC=CO3)C(=O)OC
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Product OPENEYE NAME: (2R,6S)-4-[(2S)-2-(4-methoxyphenyl)azepan-1-yl]sulfonyl-2,6-dimethyl-morpholine
CAS Name: (2R,6S)-4-[[(2S)-2-(4-methoxyphenyl)-1-azepanyl]sulfonyl]-2,6-dimethylmorpholine
IUPAC NAME: (2R,6S)-4-[(2S)-2-(4-methoxyphenyl)azepan-1-yl]sulfonyl-2,6-dimethylmorpholine
SYSTEMATIC NAME: (2R,6S)-4-[(2S)-2-(4-methoxyphenyl)azepan-1-yl]sulfonyl-2,6-dimethyl-morpholine
MOLECULAR FORMULA: C19H30N2O4S
MOLECULAR WEIGHT: 382.5175
SMILES: C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)N2CCCCC[C@H]2C3=CC=C(C=C3)OC
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Product OPENEYE NAME: (2R,6S)-4-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]sulfonyl-2,6-dimethyl-morpholine
CAS Name: (2R,6S)-4-[[(2R)-2-(4-methoxyphenyl)-1-azepanyl]sulfonyl]-2,6-dimethylmorpholine
IUPAC NAME: (2R,6S)-4-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]sulfonyl-2,6-dimethylmorpholine
SYSTEMATIC NAME: (2R,6S)-4-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]sulfonyl-2,6-dimethyl-morpholine
MOLECULAR FORMULA: C19H30N2O4S
MOLECULAR WEIGHT: 382.5175
SMILES: C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)N2CCCCC[C@@H]2C3=CC=C(C=C3)OC
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Product OPENEYE NAME: 5-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpiperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
CAS Name: 5-[[4-[[(2R,6R)-2,6-dimethyl-4-morpholinyl]sulfonyl]-1-piperazinyl]sulfonyl]-1,3-dihydrobenzimidazol-2-one
IUPAC NAME: 5-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpiperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
SYSTEMATIC NAME: 5-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpiperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
MOLECULAR FORMULA: C17H25N5O6S2
MOLECULAR WEIGHT: 459.5403
SMILES: C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)N4
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Product OPENEYE NAME: 5-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpiperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
CAS Name: 5-[[4-[[(2R,6S)-2,6-dimethyl-4-morpholinyl]sulfonyl]-1-piperazinyl]sulfonyl]-1,3-dihydrobenzimidazol-2-one
IUPAC NAME: 5-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpiperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
SYSTEMATIC NAME: 5-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpiperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
MOLECULAR FORMULA: C17H25N5O6S2
MOLECULAR WEIGHT: 459.5403
SMILES: C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)N4
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Product OPENEYE NAME: 5-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpiperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
CAS Name: 5-[[4-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]sulfonyl]-1-piperazinyl]sulfonyl]-1,3-dihydrobenzimidazol-2-one
IUPAC NAME: 5-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpiperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
SYSTEMATIC NAME: 5-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpiperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
MOLECULAR FORMULA: C17H25N5O6S2
MOLECULAR WEIGHT: 459.5403
SMILES: C[C@H]1CN(C[C@@H](O1)C)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)N4
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Product OPENEYE NAME: (2R,6R)-4-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazin-1-yl]sulfonyl-2,6-dimethyl-morpholine
CAS Name: (2R,6R)-2,6-dimethyl-4-[[4-(6-methyl-2-propan-2-yl-4-pyrimidin-3-iumyl)-1-piperazinyl]sulfonyl]morpholine
IUPAC NAME: (2R,6R)-2,6-dimethyl-4-[4-(6-methyl-2-propan-2-ylpyrimidin-3-ium-4-yl)piperazin-1-yl]sulfonylmorpholine
SYSTEMATIC NAME: (2R,6R)-2,6-dimethyl-4-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]sulfonyl-morpholine
MOLECULAR FORMULA: C18H32N5O3S+
MOLECULAR WEIGHT: 398.54338
SMILES: C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)N2CCN(CC2)C3=[NH+]C(=NC(=C3)C)C(C)C
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Product OPENEYE NAME: (2R,6R)-4-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]sulfonyl-2,6-dimethyl-morpholine
CAS Name: (2R,6R)-2,6-dimethyl-4-[[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]sulfonyl]morpholine
IUPAC NAME: (2R,6R)-2,6-dimethyl-4-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylmorpholine
SYSTEMATIC NAME: (2R,6R)-2,6-dimethyl-4-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]sulfonyl-morpholine
MOLECULAR FORMULA: C18H31N5O3S
MOLECULAR WEIGHT: 397.53544
SMILES: C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3)C)C(C)C
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Product OPENEYE NAME: (2S,6R)-4-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazin-1-yl]sulfonyl-2,6-dimethyl-morpholine
CAS Name: (2S,6R)-2,6-dimethyl-4-[[4-(6-methyl-2-propan-2-yl-4-pyrimidin-3-iumyl)-1-piperazinyl]sulfonyl]morpholine
IUPAC NAME: (2S,6R)-2,6-dimethyl-4-[4-(6-methyl-2-propan-2-ylpyrimidin-3-ium-4-yl)piperazin-1-yl]sulfonylmorpholine
SYSTEMATIC NAME: (2S,6R)-2,6-dimethyl-4-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]sulfonyl-morpholine
MOLECULAR FORMULA: C18H32N5O3S+
MOLECULAR WEIGHT: 398.54338
SMILES: C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)N2CCN(CC2)C3=[NH+]C(=NC(=C3)C)C(C)C
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