Product OPENEYE NAME: 6-(2-furyl)-3-methyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]isoxazolo[5,4-b]pyridine-4-carboxamide
CAS Name: 6-(2-furanyl)-3-methyl-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-4-isoxazolo[5,4-b]pyridinecarboxamide
IUPAC NAME: 6-(furan-2-yl)-3-methyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SYSTEMATIC NAME: 6-(furan-2-yl)-3-methyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
MOLECULAR FORMULA: C21H27N4O3+
MOLECULAR WEIGHT: 383.46408
SMILES: CC1CC[NH+](CC1)CCCNC(=O)C2=CC(=NC3=C2C(=NO3)C)C4=CC=CO4
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Product OPENEYE NAME: [(1S)-2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 4-chloro-2-nitro-benzoate
CAS Name: 4-chloro-2-nitrobenzoic acid [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl] ester
IUPAC NAME: [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl] 4-chloro-2-nitrobenzoate
SYSTEMATIC NAME: [(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-chloranyl-2-nitro-benzoate
MOLECULAR FORMULA: C17H15ClN2O5
MOLECULAR WEIGHT: 362.7644
SMILES: CN(C)C(=O)[C@H](C1=CC=CC=C1)OC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: [(1R)-2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 4-chloro-2-nitro-benzoate
CAS Name: 4-chloro-2-nitrobenzoic acid [(1R)-2-(dimethylamino)-2-oxo-1-phenylethyl] ester
IUPAC NAME: [(1R)-2-(dimethylamino)-2-oxo-1-phenylethyl] 4-chloro-2-nitrobenzoate
SYSTEMATIC NAME: [(1R)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-chloranyl-2-nitro-benzoate
MOLECULAR FORMULA: C17H15ClN2O5
MOLECULAR WEIGHT: 362.7644
SMILES: CN(C)C(=O)[C@@H](C1=CC=CC=C1)OC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: [2-[(4-fluorophenoxy)methyl]-4-methyl-thiazol-5-yl]-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone
CAS Name: [2-[(4-fluorophenoxy)methyl]-4-methyl-5-thiazolyl]-[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]methanone
IUPAC NAME: [2-[(4-fluorophenoxy)methyl]-4-methyl-1,3-thiazol-5-yl]-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone
SYSTEMATIC NAME: [2-[(4-fluoranylphenoxy)methyl]-4-methyl-1,3-thiazol-5-yl]-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone
MOLECULAR FORMULA: C24H26FN3O3S
MOLECULAR WEIGHT: 455.544943
SMILES: CC1=C(SC(=N1)COC2=CC=C(C=C2)F)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)OC
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Product OPENEYE NAME: 4-[(2-methylthiazol-4-yl)methylsulfanyl]-N-[5-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]pentyl]benzamide
CAS Name: 4-[(2-methyl-4-thiazolyl)methylthio]-N-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentyl]benzamide
IUPAC NAME: 4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-N-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentyl]benzamide
SYSTEMATIC NAME: 4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-N-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentyl]benzamide
MOLECULAR FORMULA: C23H24N4O2S3
MOLECULAR WEIGHT: 484.65726
SMILES: CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NCCCCCC3=NC(=NO3)C4=CC=CS4
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Product OPENEYE NAME: N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-6-(2-furyl)-N,3-dimethyl-isoxazolo[5,4-b]pyridine-4-carboxamide
CAS Name: N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-6-(2-furanyl)-N,3-dimethyl-4-isoxazolo[5,4-b]pyridinecarboxamide
IUPAC NAME: N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-6-(furan-2-yl)-N,3-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SYSTEMATIC NAME: N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-6-(furan-2-yl)-N,3-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
MOLECULAR FORMULA: C24H24N4O4
MOLECULAR WEIGHT: 432.47176
SMILES: CCN1C[C@H](OC2=CC=CC=C21)CN(C)C(=O)C3=CC(=NC4=C3C(=NO4)C)C5=CC=CO5
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Product OPENEYE NAME: N-[[(2R)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-6-(2-furyl)-N,3-dimethyl-isoxazolo[5,4-b]pyridine-4-carboxamide
CAS Name: N-[[(2R)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-6-(2-furanyl)-N,3-dimethyl-4-isoxazolo[5,4-b]pyridinecarboxamide
IUPAC NAME: N-[[(2R)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-6-(furan-2-yl)-N,3-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SYSTEMATIC NAME: N-[[(2R)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-6-(furan-2-yl)-N,3-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
MOLECULAR FORMULA: C24H24N4O4
MOLECULAR WEIGHT: 432.47176
SMILES: CCN1C[C@@H](OC2=CC=CC=C21)CN(C)C(=O)C3=CC(=NC4=C3C(=NO4)C)C5=CC=CO5
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Product OPENEYE NAME: N-[5-[methyl-[(2-morpholinophenyl)methyl]carbamoyl]-2-thienyl]furan-2-carboxamide
CAS Name: N-[5-[[methyl-[[2-(4-morpholinyl)phenyl]methyl]amino]-oxomethyl]-2-thiophenyl]-2-furancarboxamide
IUPAC NAME: N-[5-[methyl-[(2-morpholin-4-ylphenyl)methyl]carbamoyl]thiophen-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[5-[methyl-[(2-morpholin-4-ylphenyl)methyl]carbamoyl]thiophen-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C22H23N3O4S
MOLECULAR WEIGHT: 425.50072
SMILES: CN(CC1=CC=CC=C1N2CCOCC2)C(=O)C3=CC=C(S3)NC(=O)C4=CC=CO4
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Product OPENEYE NAME: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-[(3R,5R)-5-methyl-2-oxo-tetrahydrofuran-3-yl]oxy-methanolate
CAS Name: [6-(4-chlorophenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]-[[(3R,5R)-5-methyl-2-oxo-3-oxolanyl]oxy]methanolate
IUPAC NAME: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-[(3R,5R)-5-methyl-2-oxooxolan-3-yl]oxymethanolate
SYSTEMATIC NAME: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-[(3R,5R)-5-methyl-2-oxidanylidene-oxolan-3-yl]oxy-methanolate
MOLECULAR FORMULA: C18H15ClNO6S-
MOLECULAR WEIGHT: 408.8328
SMILES: C[C@@H]1C[C@H](C(=O)O1)OC(=C2C=CC=CC2=NS(=O)(=O)C3=CC=C(C=C3)Cl)[O-]
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Product OPENEYE NAME: [(3R,5R)-5-methyl-2-oxo-tetrahydrofuran-3-yl] 2-[(4-chlorophenyl)sulfonylamino]benzoate
CAS Name: 2-[(4-chlorophenyl)sulfonylamino]benzoic acid [(3R,5R)-5-methyl-2-oxo-3-oxolanyl] ester
IUPAC NAME: [(3R,5R)-5-methyl-2-oxooxolan-3-yl] 2-[(4-chlorophenyl)sulfonylamino]benzoate
SYSTEMATIC NAME: [(3R,5R)-5-methyl-2-oxidanylidene-oxolan-3-yl] 2-[(4-chlorophenyl)sulfonylamino]benzoate
MOLECULAR FORMULA: C18H16ClNO6S
MOLECULAR WEIGHT: 409.84074
SMILES: C[C@@H]1C[C@H](C(=O)O1)OC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-[(3R,5S)-5-methyl-2-oxo-tetrahydrofuran-3-yl]oxy-methanolate
CAS Name: [6-(4-chlorophenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]-[[(3R,5S)-5-methyl-2-oxo-3-oxolanyl]oxy]methanolate
IUPAC NAME: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-[(3R,5S)-5-methyl-2-oxooxolan-3-yl]oxymethanolate
SYSTEMATIC NAME: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-[(3R,5S)-5-methyl-2-oxidanylidene-oxolan-3-yl]oxy-methanolate
MOLECULAR FORMULA: C18H15ClNO6S-
MOLECULAR WEIGHT: 408.8328
SMILES: C[C@H]1C[C@H](C(=O)O1)OC(=C2C=CC=CC2=NS(=O)(=O)C3=CC=C(C=C3)Cl)[O-]
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Product OPENEYE NAME: [(3R,5S)-5-methyl-2-oxo-tetrahydrofuran-3-yl] 2-[(4-chlorophenyl)sulfonylamino]benzoate
CAS Name: 2-[(4-chlorophenyl)sulfonylamino]benzoic acid [(3R,5S)-5-methyl-2-oxo-3-oxolanyl] ester
IUPAC NAME: [(3R,5S)-5-methyl-2-oxooxolan-3-yl] 2-[(4-chlorophenyl)sulfonylamino]benzoate
SYSTEMATIC NAME: [(3R,5S)-5-methyl-2-oxidanylidene-oxolan-3-yl] 2-[(4-chlorophenyl)sulfonylamino]benzoate
MOLECULAR FORMULA: C18H16ClNO6S
MOLECULAR WEIGHT: 409.84074
SMILES: C[C@H]1C[C@H](C(=O)O1)OC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-[(3S,5R)-5-methyl-2-oxo-tetrahydrofuran-3-yl]oxy-methanolate
CAS Name: [6-(4-chlorophenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]-[[(3S,5R)-5-methyl-2-oxo-3-oxolanyl]oxy]methanolate
IUPAC NAME: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-[(3S,5R)-5-methyl-2-oxooxolan-3-yl]oxymethanolate
SYSTEMATIC NAME: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-[(3S,5R)-5-methyl-2-oxidanylidene-oxolan-3-yl]oxy-methanolate
MOLECULAR FORMULA: C18H15ClNO6S-
MOLECULAR WEIGHT: 408.8328
SMILES: C[C@@H]1C[C@@H](C(=O)O1)OC(=C2C=CC=CC2=NS(=O)(=O)C3=CC=C(C=C3)Cl)[O-]
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