Product OPENEYE NAME: (2S)-N-cyclopentyl-2-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide
CAS Name: (2S)-N-cyclopentyl-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]propanamide
IUPAC NAME: (2S)-N-cyclopentyl-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide
SYSTEMATIC NAME: (2S)-N-cyclopentyl-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide
MOLECULAR FORMULA: C15H20N4OS2
MOLECULAR WEIGHT: 336.4755
SMILES: C[C@@H](C(=O)NC1CCCC1)SC2=NNC(=N2)CC3=CC=CS3
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Product OPENEYE NAME: N-[(1R)-1-(o-tolyl)ethyl]-2-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide
CAS Name: N-[(1R)-1-(2-methylphenyl)ethyl]-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]acetamide
IUPAC NAME: N-[(1R)-1-(2-methylphenyl)ethyl]-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide
SYSTEMATIC NAME: N-[(1R)-1-(2-methylphenyl)ethyl]-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C18H20N4OS2
MOLECULAR WEIGHT: 372.5076
SMILES: CC1=CC=CC=C1[C@@H](C)NC(=O)CSC2=NNC(=N2)CC3=CC=CS3
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Product OPENEYE NAME: N-[(1S)-1-(o-tolyl)ethyl]-2-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide
CAS Name: N-[(1S)-1-(2-methylphenyl)ethyl]-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]acetamide
IUPAC NAME: N-[(1S)-1-(2-methylphenyl)ethyl]-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide
SYSTEMATIC NAME: N-[(1S)-1-(2-methylphenyl)ethyl]-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C18H20N4OS2
MOLECULAR WEIGHT: 372.5076
SMILES: CC1=CC=CC=C1[C@H](C)NC(=O)CSC2=NNC(=N2)CC3=CC=CS3
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Product OPENEYE NAME: N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]-2-[(6S)-6-methylspiro[3,6,7,8-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinolin-7-ium-9,1'-cyclopentane]-7-yl]acetamide
CAS Name: N-[(3S)-3-methyl-1,1-dioxo-3-thiolanyl]-2-[(6S)-6-methyl-7-spiro[3,6,7,8-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinolin-7-ium-9,1'-cyclopentane]yl]acetamide
IUPAC NAME: N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]-2-[(6S)-6-methylspiro[3,6,7,8-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinolin-7-ium-9,1'-cyclopentane]-7-yl]acetamide
SYSTEMATIC NAME: N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(6S)-6-methylspiro[3,6,7,8-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinolin-7-ium-9,1'-cyclopentane]-7-yl]ethanamide
MOLECULAR FORMULA: C23H33N2O5S+
MOLECULAR WEIGHT: 449.58352
SMILES: C[C@H]1C2=CC3=C(C=C2C4(CCCC4)C[NH+]1CC(=O)N[C@]5(CCS(=O)(=O)C5)C)OCCO3
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Product OPENEYE NAME: N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]-2-[(6S)-6-methylspiro[2,3,6,8-tetrahydro-[1,4]dioxino[2,3-g]isoquinoline-9,1'-cyclopentane]-7-yl]acetamide
CAS Name: N-[(3S)-3-methyl-1,1-dioxo-3-thiolanyl]-2-[(6S)-6-methyl-7-spiro[2,3,6,8-tetrahydro-[1,4]dioxino[2,3-g]isoquinoline-9,1'-cyclopentane]yl]acetamide
IUPAC NAME: N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]-2-[(6S)-6-methylspiro[2,3,6,8-tetrahydro-[1,4]dioxino[2,3-g]isoquinoline-9,1'-cyclopentane]-7-yl]acetamide
SYSTEMATIC NAME: N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(6S)-6-methylspiro[2,3,6,8-tetrahydro-[1,4]dioxino[2,3-g]isoquinoline-9,1'-cyclopentane]-7-yl]ethanamide
MOLECULAR FORMULA: C23H32N2O5S
MOLECULAR WEIGHT: 448.57558
SMILES: C[C@H]1C2=CC3=C(C=C2C4(CCCC4)CN1CC(=O)N[C@]5(CCS(=O)(=O)C5)C)OCCO3
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Product OPENEYE NAME: N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]-2-[(6R)-6-methylspiro[3,6,7,8-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinolin-7-ium-9,1'-cyclopentane]-7-yl]acetamide
CAS Name: N-[(3S)-3-methyl-1,1-dioxo-3-thiolanyl]-2-[(6R)-6-methyl-7-spiro[3,6,7,8-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinolin-7-ium-9,1'-cyclopentane]yl]acetamide
IUPAC NAME: N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]-2-[(6R)-6-methylspiro[3,6,7,8-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinolin-7-ium-9,1'-cyclopentane]-7-yl]acetamide
SYSTEMATIC NAME: N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(6R)-6-methylspiro[3,6,7,8-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinolin-7-ium-9,1'-cyclopentane]-7-yl]ethanamide
MOLECULAR FORMULA: C23H33N2O5S+
MOLECULAR WEIGHT: 449.58352
SMILES: C[C@@H]1C2=CC3=C(C=C2C4(CCCC4)C[NH+]1CC(=O)N[C@]5(CCS(=O)(=O)C5)C)OCCO3
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Product OPENEYE NAME: N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]-2-[(6R)-6-methylspiro[2,3,6,8-tetrahydro-[1,4]dioxino[2,3-g]isoquinoline-9,1'-cyclopentane]-7-yl]acetamide
CAS Name: N-[(3S)-3-methyl-1,1-dioxo-3-thiolanyl]-2-[(6R)-6-methyl-7-spiro[2,3,6,8-tetrahydro-[1,4]dioxino[2,3-g]isoquinoline-9,1'-cyclopentane]yl]acetamide
IUPAC NAME: N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]-2-[(6R)-6-methylspiro[2,3,6,8-tetrahydro-[1,4]dioxino[2,3-g]isoquinoline-9,1'-cyclopentane]-7-yl]acetamide
SYSTEMATIC NAME: N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(6R)-6-methylspiro[2,3,6,8-tetrahydro-[1,4]dioxino[2,3-g]isoquinoline-9,1'-cyclopentane]-7-yl]ethanamide
MOLECULAR FORMULA: C23H32N2O5S
MOLECULAR WEIGHT: 448.57558
SMILES: C[C@@H]1C2=CC3=C(C=C2C4(CCCC4)CN1CC(=O)N[C@]5(CCS(=O)(=O)C5)C)OCCO3
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H22N4O2S
MOLECULAR WEIGHT: 382.47928
SMILES: CC1=NC(=C2C3=C(CCC3)SC2=N1)NC4CCN(CC4)C(=O)C5=CC=CO5
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Product OPENEYE NAME: 2-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]-4-pyrrolidin-1-ylsulfonyl-aniline
CAS Name: 2-nitro-N-[2-(1-phenyl-4-pyrazolyl)ethyl]-4-(1-pyrrolidinylsulfonyl)aniline
IUPAC NAME: 2-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]-4-pyrrolidin-1-ylsulfonylaniline
SYSTEMATIC NAME: 2-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]-4-pyrrolidin-1-ylsulfonyl-aniline
MOLECULAR FORMULA: C21H23N5O4S
MOLECULAR WEIGHT: 441.50342
SMILES: C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]
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Product OPENEYE NAME: 4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]aniline
CAS Name: 4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-nitro-N-[2-(1-phenyl-4-pyrazolyl)ethyl]aniline
IUPAC NAME: 4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]aniline
SYSTEMATIC NAME: 4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]aniline
MOLECULAR FORMULA: C22H27N6O4S+
MOLECULAR WEIGHT: 471.55258
SMILES: C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]
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Product OPENEYE NAME: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]aniline
CAS Name: 4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitro-N-[2-(1-phenyl-4-pyrazolyl)ethyl]aniline
IUPAC NAME: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]aniline
SYSTEMATIC NAME: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[2-(1-phenylpyrazol-4-yl)ethyl]aniline
MOLECULAR FORMULA: C22H26N6O4S
MOLECULAR WEIGHT: 470.54464
SMILES: CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]
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Product OPENEYE NAME: 4-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-3-nitro-N-phenyl-benzenesulfonamide
CAS Name: 4-[2-(2-imidazo[1,2-a]pyridinyl)ethylamino]-3-nitro-N-phenylbenzenesulfonamide
IUPAC NAME: 4-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-3-nitro-N-phenylbenzenesulfonamide
SYSTEMATIC NAME: 4-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-3-nitro-N-phenyl-benzenesulfonamide
MOLECULAR FORMULA: C21H19N5O4S
MOLECULAR WEIGHT: 437.47166
SMILES: C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NCCC3=CN4C=CC=CC4=N3)[N+](=O)[O-]
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Product OPENEYE NAME: 4-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-N-methyl-3-nitro-benzenesulfonamide
CAS Name: 4-[2-(2-imidazo[1,2-a]pyridinyl)ethylamino]-N-methyl-3-nitrobenzenesulfonamide
IUPAC NAME: 4-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-N-methyl-3-nitrobenzenesulfonamide
SYSTEMATIC NAME: 4-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-N-methyl-3-nitro-benzenesulfonamide
MOLECULAR FORMULA: C16H17N5O4S
MOLECULAR WEIGHT: 375.40228
SMILES: CNS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CN3C=CC=CC3=N2)[N+](=O)[O-]
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Product OPENEYE NAME: 4-(4-hydroxyphenyl)-N-(p-tolylmethyl)piperidine-1-carboxamide
CAS Name: 4-(4-hydroxyphenyl)-N-[(4-methylphenyl)methyl]-1-piperidinecarboxamide
IUPAC NAME: 4-(4-hydroxyphenyl)-N-[(4-methylphenyl)methyl]piperidine-1-carboxamide
SYSTEMATIC NAME: 4-(4-hydroxyphenyl)-N-[(4-methylphenyl)methyl]piperidine-1-carboxamide
MOLECULAR FORMULA: C20H24N2O2
MOLECULAR WEIGHT: 324.41676
SMILES: CC1=CC=C(C=C1)CNC(=O)N2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: N-benzyl-4-(4-hydroxyphenyl)piperidine-1-carboxamide
CAS Name: 4-(4-hydroxyphenyl)-N-(phenylmethyl)-1-piperidinecarboxamide
IUPAC NAME: N-benzyl-4-(4-hydroxyphenyl)piperidine-1-carboxamide
SYSTEMATIC NAME: 4-(4-hydroxyphenyl)-N-(phenylmethyl)piperidine-1-carboxamide
MOLECULAR FORMULA: C19H22N2O2
MOLECULAR WEIGHT: 310.39018
SMILES: C1CN(CCC1C2=CC=C(C=C2)O)C(=O)NCC3=CC=CC=C3
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Product OPENEYE NAME: 4-(4-hydroxyphenyl)-N-[(1S)-1-methyl-3-phenyl-propyl]piperidine-1-carboxamide
CAS Name: 4-(4-hydroxyphenyl)-N-[(2S)-4-phenylbutan-2-yl]-1-piperidinecarboxamide
IUPAC NAME: 4-(4-hydroxyphenyl)-N-[(2S)-4-phenylbutan-2-yl]piperidine-1-carboxamide
SYSTEMATIC NAME: 4-(4-hydroxyphenyl)-N-[(2S)-4-phenylbutan-2-yl]piperidine-1-carboxamide
MOLECULAR FORMULA: C22H28N2O2
MOLECULAR WEIGHT: 352.46992
SMILES: C[C@@H](CCC1=CC=CC=C1)NC(=O)N2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: 4-(4-hydroxyphenyl)-N-[(1R)-1-methyl-3-phenyl-propyl]piperidine-1-carboxamide
CAS Name: 4-(4-hydroxyphenyl)-N-[(2R)-4-phenylbutan-2-yl]-1-piperidinecarboxamide
IUPAC NAME: 4-(4-hydroxyphenyl)-N-[(2R)-4-phenylbutan-2-yl]piperidine-1-carboxamide
SYSTEMATIC NAME: 4-(4-hydroxyphenyl)-N-[(2R)-4-phenylbutan-2-yl]piperidine-1-carboxamide
MOLECULAR FORMULA: C22H28N2O2
MOLECULAR WEIGHT: 352.46992
SMILES: C[C@H](CCC1=CC=CC=C1)NC(=O)N2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: N-(1-benzylpiperidin-1-ium-4-yl)-4-(4-hydroxyphenyl)piperidine-1-carboxamide
CAS Name: 4-(4-hydroxyphenyl)-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-1-piperidinecarboxamide
IUPAC NAME: N-(1-benzylpiperidin-1-ium-4-yl)-4-(4-hydroxyphenyl)piperidine-1-carboxamide
SYSTEMATIC NAME: 4-(4-hydroxyphenyl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperidine-1-carboxamide
MOLECULAR FORMULA: C24H32N3O2+
MOLECULAR WEIGHT: 394.52978
SMILES: C1C[NH+](CCC1NC(=O)N2CCC(CC2)C3=CC=C(C=C3)O)CC4=CC=CC=C4
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Product OPENEYE NAME: N-(1-benzyl-4-piperidyl)-4-(4-hydroxyphenyl)piperidine-1-carboxamide
CAS Name: 4-(4-hydroxyphenyl)-N-[1-(phenylmethyl)-4-piperidinyl]-1-piperidinecarboxamide
IUPAC NAME: N-(1-benzylpiperidin-4-yl)-4-(4-hydroxyphenyl)piperidine-1-carboxamide
SYSTEMATIC NAME: 4-(4-hydroxyphenyl)-N-[1-(phenylmethyl)piperidin-4-yl]piperidine-1-carboxamide
MOLECULAR FORMULA: C24H31N3O2
MOLECULAR WEIGHT: 393.52184
SMILES: C1CN(CCC1C2=CC=C(C=C2)O)C(=O)NC3CCN(CC3)CC4=CC=CC=C4
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