4-[5-phenyl-4-(3-phenylsulfanylphenyl)-1H-imidazol-2-yl]benzoic acid

Systemtic Name: 4-[5-phenyl-4-(3-phenylsulfanylphenyl)-1H-imidazol-2-yl]benzoic acid Openeye Name: 4-[5-phenyl-4-(3-phenylsulfanylphenyl)-1H-imidazol-2-yl]benzoic acid CAS Name: 4-[5-phenyl-4-[3-(phenylthio)phenyl]-1H-imidazol-2-yl]benzoic acid IUPAC Name: 4-[5-phenyl-4-(3-phenylsulfanylphenyl)-1H-imidazol-2-yl]benzoic acid Traditional Name: 4-[5-phenyl-4-[3-(phenylthio)phenyl]-1H-imidazol-2-yl]benzoic acid Formula: C28H20N2O2S MolecularWeight: 448.5356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(N2)C3=CC=C(C=C3)C(=O)O)C4=CC(=CC=C4)SC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(N2)C3=CC=C(C=C3)C(=O)O)C4=CC(=CC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C28H20N2O2S/c31-28(32)21-16-14-20(15-17-21)27-29-25(19-8-3-1-4-9-19)26(30-27)22-10-7-13-24(18-22)33-23-11-5-2-6-12-23/h1-18H,(H,29,30)(H,31,32)