S-[2-(4-methylphenyl)-5-(phenylsulfonyl)-1H-imidazol-4-yl] ethanethioate

Systemtic Name: S-[2-(4-methylphenyl)-5-(phenylsulfonyl)-1H-imidazol-4-yl] ethanethioate Openeye Name: S-[5-(benzenesulfonyl)-2-(p-tolyl)-1H-imidazol-4-yl] ethanethioate CAS Name: ethanethioic acid S-[5-(benzenesulfonyl)-2-(4-methylphenyl)-1H-imidazol-4-yl] ester IUPAC Name: S-[5-(benzenesulfonyl)-2-(4-methylphenyl)-1H-imidazol-4-yl] ethanethioate Traditional Name: ethanethioic acid S-[5-besyl-2-(p-tolyl)-1H-imidazol-4-yl] ester Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(N2)S(=O)(=O)C3=CC=CC=C3)SC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(N2)S(=O)(=O)C3=CC=CC=C3)SC(=O)C

InChI

InChI=1S/C18H16N2O3S2/c1-12-8-10-14(11-9-12)16-19-17(24-13(2)21)18(20-16)25(22,23)15-6-4-3-5-7-15/h3-11H,1-2H3,(H,19,20)