2-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[benzyl(methyl)sulfamoyl]phenyl]-3H-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-[4-[benzyl(methyl)sulfamoyl]phenyl]-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-[4-[benzyl(methyl)sulfamoyl]phenyl]-3H-benzimidazole-5-carboxylic acid Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)C(=O)O

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)C(=O)O

InChI

InChI=1S/C22H19N3O4S/c1-25(14-15-5-3-2-4-6-15)30(28,29)18-10-7-16(8-11-18)21-23-19-12-9-17(22(26)27)13-20(19)24-21/h2-13H,14H2,1H3,(H,23,24)(H,26,27)