3-(4-methylphenyl)-2-(pyridin-2-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(4-methylphenyl)-2-(pyridin-2-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-(p-tolyl)-2-(2-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(4-methylphenyl)-2-(2-pyridinylmethylthio)-4-quinazolinone IUPAC Name: 3-(4-methylphenyl)-2-(pyridin-2-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-(p-tolyl)-2-(2-pyridylmethylthio)quinazolin-4-one Formula: C21H17N3OS MolecularWeight: 359.44418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=N4

InChI

InChI=1S/C21H17N3OS/c1-15-9-11-17(12-10-15)24-20(25)18-7-2-3-8-19(18)23-21(24)26-14-16-6-4-5-13-22-16/h2-13H,14H2,1H3