3,4-dimethyl-5-[[[3-(4-methylphenyl)thiophen-2-yl]carbonylamino]sulfamoyl]benzoic acid

Systemtic Name: 3,4-dimethyl-5-[[[3-(4-methylphenyl)thiophen-2-yl]carbonylamino]sulfamoyl]benzoic acid Openeye Name: 3,4-dimethyl-5-[[[3-(p-tolyl)thiophene-2-carbonyl]amino]sulfamoyl]benzoic acid CAS Name: 3,4-dimethyl-5-[[[[3-(4-methylphenyl)-2-thiophenyl]-oxomethyl]amino]sulfamoyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-[[[3-(4-methylphenyl)thiophene-2-carbonyl]amino]sulfamoyl]benzoic acid Traditional Name: 3,4-dimethyl-5-[[[3-(p-tolyl)thiophene-2-carbonyl]amino]sulfamoyl]benzoic acid Formula: C21H20N2O5S2 MolecularWeight: 444.5239

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC=C2)C(=O)NNS(=O)(=O)C3=CC(=CC(=C3C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC=C2)C(=O)NNS(=O)(=O)C3=CC(=CC(=C3C)C)C(=O)O

InChI

InChI=1S/C21H20N2O5S2/c1-12-4-6-15(7-5-12)17-8-9-29-19(17)20(24)22-23-30(27,28)18-11-16(21(25)26)10-13(2)14(18)3/h4-11,23H,1-3H3,(H,22,24)(H,25,26)