2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]-3-(4-phenylmethoxyphenyl)propanoic acid

Systemtic Name: 2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]-3-(4-phenylmethoxyphenyl)propanoic acid Openeye Name: 3-(4-benzyloxyphenyl)-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]propanoic acid CAS Name: 2-[(5-phenyl-1H-imidazol-2-yl)thio]-3-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]-3-(4-phenylmethoxyphenyl)propanoic acid Traditional Name: 3-(4-benzoxyphenyl)-2-[(5-phenyl-1H-imidazol-2-yl)thio]propionic acid Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)O)SC3=NC=C(N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)O)SC3=NC=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3S/c28-24(29)23(31-25-26-16-22(27-25)20-9-5-2-6-10-20)15-18-11-13-21(14-12-18)30-17-19-7-3-1-4-8-19/h1-14,16,23H,15,17H2,(H,26,27)(H,28,29)