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

Systemtic Name: S-[5-(4-methylphenyl)sulfonyl-2-phenyl-1H-imidazol-4-yl] ethanethioate Openeye Name: S-[2-phenyl-5-(p-tolylsulfonyl)-1H-imidazol-4-yl] ethanethioate CAS Name: ethanethioic acid S-[5-(4-methylphenyl)sulfonyl-2-phenyl-1H-imidazol-4-yl] ester IUPAC Name: S-[5-(4-methylphenyl)sulfonyl-2-phenyl-1H-imidazol-4-yl] ethanethioate Traditional Name: ethanethioic acid S-(2-phenyl-5-tosyl-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)S(=O)(=O)C2=C(N=C(N2)C3=CC=CC=C3)SC(=O)C

Isomeric SMILES

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

InChI

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