2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanenitrile Openeye Name: 2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanylacetonitrile CAS Name: 2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetonitrile IUPAC Name: 2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]acetonitrile Formula: C17H13N3OS MolecularWeight: 307.36962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC#N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC#N

InChI

InChI=1S/C17H13N3OS/c1-12-6-8-13(9-7-12)20-16(21)14-4-2-3-5-15(14)19-17(20)22-11-10-18/h2-9H,11H2,1H3