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

Systemtic Name: 3,4-dimethyl-5-[[4-(4-methyl-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoic acid Openeye Name: 3,4-dimethyl-5-[[4-(4-methyl-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoic acid CAS Name: 3,4-dimethyl-5-[[4-(4-methyl-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-[[4-(4-methyl-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoic acid Traditional Name: 3,4-dimethyl-5-[[4-(4-methyl-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoic acid Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NC2=CC=C(C=C2)C3=NN=CN3C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NC2=CC=C(C=C2)C3=NN=CN3C)C

InChI

InChI=1S/C18H18N4O4S/c1-11-8-14(18(23)24)9-16(12(11)2)27(25,26)21-15-6-4-13(5-7-15)17-20-19-10-22(17)3/h4-10,21H,1-3H3,(H,23,24)