4-[[7-chloranyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[7-chloranyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[7-chloro-3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[7-chloro-3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]methyl]benzonitrile IUPAC Name: 4-[[7-chloro-3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[7-chloro-4-keto-3-(o-tolyl)quinazolin-2-yl]thio]methyl]benzonitrile Formula: C23H16ClN3OS MolecularWeight: 417.91064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H16ClN3OS/c1-15-4-2-3-5-21(15)27-22(28)19-11-10-18(24)12-20(19)26-23(27)29-14-17-8-6-16(13-25)7-9-17/h2-12H,14H2,1H3