3-[(4-methylphenyl)methyl]-2-(oxan-2-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-[(4-methylphenyl)methyl]-2-(oxan-2-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-(p-tolylmethyl)-2-(tetrahydropyran-2-ylmethylsulfanyl)quinazolin-4-one CAS Name: 3-[(4-methylphenyl)methyl]-2-(2-oxanylmethylthio)-4-quinazolinone IUPAC Name: 3-[(4-methylphenyl)methyl]-2-(oxan-2-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-(4-methylbenzyl)-2-(tetrahydropyran-2-ylmethylthio)quinazolin-4-one Formula: C22H24N2O2S MolecularWeight: 380.50316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4CCCCO4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4CCCCO4

InChI

InChI=1S/C22H24N2O2S/c1-16-9-11-17(12-10-16)14-24-21(25)19-7-2-3-8-20(19)23-22(24)27-15-18-6-4-5-13-26-18/h2-3,7-12,18H,4-6,13-15H2,1H3