5-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]benzamide

Systemtic Name: 5-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]benzamide Openeye Name: 5-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)sulfamoyl]-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]benzamide CAS Name: 5-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)sulfamoyl]-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]benzamide IUPAC Name: 5-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)sulfamoyl]-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]benzamide Traditional Name: 5-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)sulfamoyl]-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]benzamide Formula: C27H29N5O6S2 MolecularWeight: 583.67906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C27H29N5O6S2/c1-18-9-12-23(17-24(18)26(33)29-16-15-20-10-13-22(14-11-20)39(28,35)36)40(37,38)30-25-19(2)31(3)32(27(25)34)21-7-5-4-6-8-21/h4-14,17,30H,15-16H2,1-3H3,(H,29,33)(H2,28,35,36)