2-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methylphenyl)propanamide

Systemtic Name: 2-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methylphenyl)propanamide Openeye Name: 2-[3-(3-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(o-tolyl)propanamide CAS Name: 2-[[3-(3-chlorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(2-methylphenyl)propanamide IUPAC Name: 2-[3-(3-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-methylphenyl)propanamide Traditional Name: 2-[[3-(3-chlorophenyl)-4-keto-quinazolin-2-yl]thio]-N-(o-tolyl)propionamide Formula: C24H20ClN3O2S MolecularWeight: 449.9525

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H20ClN3O2S/c1-15-8-3-5-12-20(15)26-22(29)16(2)31-24-27-21-13-6-4-11-19(21)23(30)28(24)18-10-7-9-17(25)14-18/h3-14,16H,1-2H3,(H,26,29)