2-methyl-7-[[2-(phenylsulfonylmethyl)phenyl]methyl]-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-methyl-7-[[2-(phenylsulfonylmethyl)phenyl]methyl]-3H-benzimidazole-5-carboxylic acid Openeye Name: 7-[[2-(benzenesulfonylmethyl)phenyl]methyl]-2-methyl-3H-benzimidazole-5-carboxylic acid CAS Name: 7-[[2-(benzenesulfonylmethyl)phenyl]methyl]-2-methyl-3H-benzimidazole-5-carboxylic acid IUPAC Name: 7-[[2-(benzenesulfonylmethyl)phenyl]methyl]-2-methyl-3H-benzimidazole-5-carboxylic acid Traditional Name: 7-[2-(besylmethyl)benzyl]-2-methyl-3H-benzimidazole-5-carboxylic acid Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2N1)C(=O)O)CC3=CC=CC=C3CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C=C(C=C2N1)C(=O)O)CC3=CC=CC=C3CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H20N2O4S/c1-15-24-21-13-19(23(26)27)12-18(22(21)25-15)11-16-7-5-6-8-17(16)14-30(28,29)20-9-3-2-4-10-20/h2-10,12-13H,11,14H2,1H3,(H,24,25)(H,26,27)