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

Systemtic Name: 2-(4-methoxyphenyl)-3-(2-methylphenyl)-6-oxidanylidene-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile Openeye Name: 2-(4-methoxyphenyl)-3-(o-tolyl)-6-oxo-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile CAS Name: 4-mercapto-2-(4-methoxyphenyl)-3-(2-methylphenyl)-6-oxo-1,2-dihydropyrimidine-5-carbonitrile IUPAC Name: 2-(4-methoxyphenyl)-3-(2-methylphenyl)-6-oxo-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile Traditional Name: 6-keto-4-mercapto-2-(4-methoxyphenyl)-3-(o-tolyl)-1,2-dihydropyrimidine-5-carbonitrile Formula: C19H17N3O2S MolecularWeight: 351.42218

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O2S/c1-12-5-3-4-6-16(12)22-17(13-7-9-14(24-2)10-8-13)21-18(23)15(11-20)19(22)25/h3-10,17,25H,1-2H3,(H,21,23)