[2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 4-chloranyl-3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]benzoate

Systemtic Name: [2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 4-chloranyl-3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]benzoate Openeye Name: [2-(benzofuran-2-yl)-2-oxo-ethyl] 4-chloro-3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)sulfamoyl]benzoate CAS Name: 4-chloro-3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)sulfamoyl]benzoic acid [2-(2-benzofuranyl)-2-oxoethyl] ester IUPAC Name: [2-(1-benzofuran-2-yl)-2-oxoethyl] 4-chloro-3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)sulfamoyl]benzoate Traditional Name: 4-chloro-3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)sulfamoyl]benzoic acid [2-(benzofuran-2-yl)-2-keto-ethyl] ester Formula: C28H22ClN3O7S MolecularWeight: 580.00818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)OCC(=O)C4=CC5=CC=CC=C5O4)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)OCC(=O)C4=CC5=CC=CC=C5O4)Cl

InChI

InChI=1S/C28H22ClN3O7S/c1-17-26(27(34)32(31(17)2)20-9-4-3-5-10-20)30-40(36,37)25-15-19(12-13-21(25)29)28(35)38-16-22(33)24-14-18-8-6-7-11-23(18)39-24/h3-15,30H,16H2,1-2H3