3-(2-methylphenyl)-2-(2-oxidanylidenecyclohexyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-methylphenyl)-2-(2-oxidanylidenecyclohexyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(o-tolyl)-2-(2-oxocyclohexyl)sulfanyl-quinazolin-4-one CAS Name: 3-(2-methylphenyl)-2-[(2-oxocyclohexyl)thio]-4-quinazolinone IUPAC Name: 3-(2-methylphenyl)-2-(2-oxocyclohexyl)sulfanylquinazolin-4-one Traditional Name: 2-[(2-ketocyclohexyl)thio]-3-(o-tolyl)quinazolin-4-one Formula: C21H20N2O2S MolecularWeight: 364.4607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC4CCCCC4=O

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC4CCCCC4=O

InChI

InChI=1S/C21H20N2O2S/c1-14-8-2-5-11-17(14)23-20(25)15-9-3-4-10-16(15)22-21(23)26-19-13-7-6-12-18(19)24/h2-5,8-11,19H,6-7,12-13H2,1H3