2-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(propylcarbamoyl)ethanamide

Systemtic Name: 2-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(propylcarbamoyl)ethanamide Openeye Name: 2-[3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(propylcarbamoyl)acetamide CAS Name: 2-[[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[oxo(propylamino)methyl]acetamide IUPAC Name: 2-[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(propylcarbamoyl)acetamide Traditional Name: 2-[[4-keto-3-(o-tolyl)quinazolin-2-yl]thio]-N-(propylcarbamoyl)acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C

Isomeric SMILES

CCCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C

InChI

InChI=1S/C21H22N4O3S/c1-3-12-22-20(28)24-18(26)13-29-21-23-16-10-6-5-9-15(16)19(27)25(21)17-11-7-4-8-14(17)2/h4-11H,3,12-13H2,1-2H3,(H2,22,24,26,28)