3-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanylmethyl]benzoic acid

Systemtic Name: 3-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanylmethyl]benzoic acid Openeye Name: 3-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanylmethyl]benzoic acid CAS Name: 3-[[(4,5-diphenyl-1H-imidazol-2-yl)thio]methyl]benzoic acid IUPAC Name: 3-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanylmethyl]benzoic acid Traditional Name: 3-[[(4,5-diphenyl-1H-imidazol-2-yl)thio]methyl]benzoic acid Formula: C23H18N2O2S MolecularWeight: 386.46622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(N2)SCC3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(N2)SCC3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C23H18N2O2S/c26-22(27)19-13-7-8-16(14-19)15-28-23-24-20(17-9-3-1-4-10-17)21(25-23)18-11-5-2-6-12-18/h1-14H,15H2,(H,24,25)(H,26,27)