[(2-chlorophenyl)-(4,6-dimethylpyrimidin-2-yl)sulfanyl-methyl] benzoate

Systemtic Name: [(2-chlorophenyl)-(4,6-dimethylpyrimidin-2-yl)sulfanyl-methyl] benzoate Openeye Name: [(2-chlorophenyl)-(4,6-dimethylpyrimidin-2-yl)sulfanyl-methyl] benzoate CAS Name: benzoic acid [(2-chlorophenyl)-[(4,6-dimethyl-2-pyrimidinyl)thio]methyl] ester IUPAC Name: [(2-chlorophenyl)-(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl] benzoate Traditional Name: benzoic acid [(2-chlorophenyl)-[(4,6-dimethylpyrimidin-2-yl)thio]methyl] ester Formula: C20H17ClN2O2S MolecularWeight: 384.87918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(C2=CC=CC=C2Cl)OC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC(C2=CC=CC=C2Cl)OC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H17ClN2O2S/c1-13-12-14(2)23-20(22-13)26-19(16-10-6-7-11-17(16)21)25-18(24)15-8-4-3-5-9-15/h3-12,19H,1-2H3