2-(1H-imidazol-2-yl)-2-(2-methyl-3-sulfanyl-phenyl)-2-phenyl-ethanoic acid

Systemtic Name: 2-(1H-imidazol-2-yl)-2-(2-methyl-3-sulfanyl-phenyl)-2-phenyl-ethanoic acid Openeye Name: 2-(1H-imidazol-2-yl)-2-(2-methyl-3-sulfanyl-phenyl)-2-phenyl-acetic acid CAS Name: 2-(1H-imidazol-2-yl)-2-(3-mercapto-2-methylphenyl)-2-phenylacetic acid IUPAC Name: 2-(1H-imidazol-2-yl)-2-(2-methyl-3-sulfanylphenyl)-2-phenylacetic acid Traditional Name: 2-(1H-imidazol-2-yl)-2-(3-mercapto-2-methyl-phenyl)-2-phenyl-acetic acid Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S)C(C2=CC=CC=C2)(C3=NC=CN3)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1S)C(C2=CC=CC=C2)(C3=NC=CN3)C(=O)O

InChI

InChI=1S/C18H16N2O2S/c1-12-14(8-5-9-15(12)23)18(17(21)22,16-19-10-11-20-16)13-6-3-2-4-7-13/h2-11,23H,1H3,(H,19,20)(H,21,22)