6-(4-chlorophenyl)-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-chlorophenyl)-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-chlorophenyl)-4-oxo-2-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-chlorophenyl)-2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-chlorophenyl)-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(4-chlorophenyl)-4-keto-2-[[2-keto-2-(p-tolyl)ethyl]thio]-1H-pyrimidine-5-carbonitrile Formula: C20H14ClN3O2S MolecularWeight: 395.86206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C(=C(N2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C(=C(N2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C20H14ClN3O2S/c1-12-2-4-13(5-3-12)17(25)11-27-20-23-18(16(10-22)19(26)24-20)14-6-8-15(21)9-7-14/h2-9H,11H2,1H3,(H,23,24,26)