4-[5-(4-chlorophenyl)sulfanyl-1-methyl-2-phenyl-imidazol-4-yl]benzoic acid

Systemtic Name: 4-[5-(4-chlorophenyl)sulfanyl-1-methyl-2-phenyl-imidazol-4-yl]benzoic acid Openeye Name: 4-[5-(4-chlorophenyl)sulfanyl-1-methyl-2-phenyl-imidazol-4-yl]benzoic acid CAS Name: 4-[5-[(4-chlorophenyl)thio]-1-methyl-2-phenyl-4-imidazolyl]benzoic acid IUPAC Name: 4-[5-(4-chlorophenyl)sulfanyl-1-methyl-2-phenylimidazol-4-yl]benzoic acid Traditional Name: 4-[5-[(4-chlorophenyl)thio]-1-methyl-2-phenyl-imidazol-4-yl]benzoic acid Formula: C23H17ClN2O2S MolecularWeight: 420.91128

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)O)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(=C(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)O)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H17ClN2O2S/c1-26-21(16-5-3-2-4-6-16)25-20(15-7-9-17(10-8-15)23(27)28)22(26)29-19-13-11-18(24)12-14-19/h2-14H,1H3,(H,27,28)