2-(4-chlorophenyl)-3-(2-methylphenyl)-6-oxidanylidene-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile

Systemtic Name: 2-(4-chlorophenyl)-3-(2-methylphenyl)-6-oxidanylidene-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile Openeye Name: 2-(4-chlorophenyl)-3-(o-tolyl)-6-oxo-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile CAS Name: 2-(4-chlorophenyl)-4-mercapto-3-(2-methylphenyl)-6-oxo-1,2-dihydropyrimidine-5-carbonitrile IUPAC Name: 2-(4-chlorophenyl)-3-(2-methylphenyl)-6-oxo-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile Traditional Name: 2-(4-chlorophenyl)-6-keto-4-mercapto-3-(o-tolyl)-1,2-dihydropyrimidine-5-carbonitrile Formula: C18H14ClN3OS MolecularWeight: 355.84126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(NC(=O)C(=C2S)C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1N2C(NC(=O)C(=C2S)C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H14ClN3OS/c1-11-4-2-3-5-15(11)22-16(12-6-8-13(19)9-7-12)21-17(23)14(10-20)18(22)24/h2-9,16,24H,1H3,(H,21,23)