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

Systemtic Name: 3-(2-methylphenyl)-2-(oxan-2-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-(o-tolyl)-2-(tetrahydropyran-2-ylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(2-methylphenyl)-2-(2-oxanylmethylthio)-4-quinazolinone IUPAC Name: 3-(2-methylphenyl)-2-(oxan-2-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-(o-tolyl)-2-(tetrahydropyran-2-ylmethylthio)quinazolin-4-one Formula: C21H22N2O2S MolecularWeight: 366.47658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4CCCCO4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4CCCCO4

InChI

InChI=1S/C21H22N2O2S/c1-15-8-2-5-12-19(15)23-20(24)17-10-3-4-11-18(17)22-21(23)26-14-16-9-6-7-13-25-16/h2-5,8,10-12,16H,6-7,9,13-14H2,1H3