2-[[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]sulfonylmethyl]benzoic acid

Systemtic Name: 2-[[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]sulfonylmethyl]benzoic acid Openeye Name: 2-[[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]sulfonylmethyl]benzoic acid CAS Name: 2-[[1-[(2,5-dimethylphenyl)methyl]-2-benzimidazolyl]sulfonylmethyl]benzoic acid IUPAC Name: 2-[[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]sulfonylmethyl]benzoic acid Traditional Name: 2-[[1-(2,5-dimethylbenzyl)benzimidazol-2-yl]sulfonylmethyl]benzoic acid Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3N=C2S(=O)(=O)CC4=CC=CC=C4C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3N=C2S(=O)(=O)CC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C24H22N2O4S/c1-16-11-12-17(2)19(13-16)14-26-22-10-6-5-9-21(22)25-24(26)31(29,30)15-18-7-3-4-8-20(18)23(27)28/h3-13H,14-15H2,1-2H3,(H,27,28)