N-(4-chlorophenyl)-2-[6-methyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-chlorophenyl)-2-[6-methyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-yl]sulfanyl-ethanamide Openeye Name: N-(4-chlorophenyl)-2-[6-methyl-2-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-pyrimidin-4-yl]sulfanyl-acetamide CAS Name: N-(4-chlorophenyl)-2-[[6-methyl-2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-4-pyrimidinyl]thio]acetamide IUPAC Name: N-(4-chlorophenyl)-2-[6-methyl-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyrimidin-4-yl]sulfanylacetamide Traditional Name: N-(4-chlorophenyl)-2-[[2-[[2-keto-2-(p-tolyl)ethyl]thio]-6-methyl-pyrimidin-4-yl]thio]acetamide Formula: C22H20ClN3O2S2 MolecularWeight: 457.9961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC(=CC(=N2)SCC(=O)NC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC(=CC(=N2)SCC(=O)NC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H20ClN3O2S2/c1-14-3-5-16(6-4-14)19(27)12-30-22-24-15(2)11-21(26-22)29-13-20(28)25-18-9-7-17(23)8-10-18/h3-11H,12-13H2,1-2H3,(H,25,28)