4-[[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)carbonylamino]sulfamoyl]benzoic acid

Systemtic Name: 4-[[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)carbonylamino]sulfamoyl]benzoic acid Openeye Name: 4-[[(2,5-dimethyl-1-phenyl-pyrrole-3-carbonyl)amino]sulfamoyl]benzoic acid CAS Name: 4-[[[(2,5-dimethyl-1-phenyl-3-pyrrolyl)-oxomethyl]amino]sulfamoyl]benzoic acid IUPAC Name: 4-[[(2,5-dimethyl-1-phenylpyrrole-3-carbonyl)amino]sulfamoyl]benzoic acid Traditional Name: 4-[[(2,5-dimethyl-1-phenyl-pyrrole-3-carbonyl)amino]sulfamoyl]benzoic acid Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H19N3O5S/c1-13-12-18(14(2)23(13)16-6-4-3-5-7-16)19(24)21-22-29(27,28)17-10-8-15(9-11-17)20(25)26/h3-12,22H,1-2H3,(H,21,24)(H,25,26)