4-[1-(2-chlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylbenzoic acid

Systemtic Name: 4-[1-(2-chlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylbenzoic acid Openeye Name: 4-[1-(2-chlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylbenzoic acid CAS Name: 4-[[1-(2-chlorophenyl)-2-(1-imidazolyl)ethyl]thio]benzoic acid IUPAC Name: 4-[1-(2-chlorophenyl)-2-imidazol-1-ylethyl]sulfanylbenzoic acid Traditional Name: 4-[[1-(2-chlorophenyl)-2-imidazol-1-yl-ethyl]thio]benzoic acid Formula: C18H15ClN2O2S MolecularWeight: 358.8419

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(CN2C=CN=C2)SC3=CC=C(C=C3)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(CN2C=CN=C2)SC3=CC=C(C=C3)C(=O)O)Cl

InChI

InChI=1S/C18H15ClN2O2S/c19-16-4-2-1-3-15(16)17(11-21-10-9-20-12-21)24-14-7-5-13(6-8-14)18(22)23/h1-10,12,17H,11H2,(H,22,23)