2-[[1-[(4-phenylphenyl)methyl]benzimidazol-2-yl]sulfanylmethyl]benzoic acid

Systemtic Name: 2-[[1-[(4-phenylphenyl)methyl]benzimidazol-2-yl]sulfanylmethyl]benzoic acid Openeye Name: 2-[[1-[(4-phenylphenyl)methyl]benzimidazol-2-yl]sulfanylmethyl]benzoic acid CAS Name: 2-[[[1-[(4-phenylphenyl)methyl]-2-benzimidazolyl]thio]methyl]benzoic acid IUPAC Name: 2-[[1-[(4-phenylphenyl)methyl]benzimidazol-2-yl]sulfanylmethyl]benzoic acid Traditional Name: 2-[[[1-(4-phenylbenzyl)benzimidazol-2-yl]thio]methyl]benzoic acid Formula: C28H22N2O2S MolecularWeight: 450.55148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5C(=O)O

InChI

InChI=1S/C28H22N2O2S/c31-27(32)24-11-5-4-10-23(24)19-33-28-29-25-12-6-7-13-26(25)30(28)18-20-14-16-22(17-15-20)21-8-2-1-3-9-21/h1-17H,18-19H2,(H,31,32)