N-(4-acetamidophenyl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-acetamidophenyl)-2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(4-acetamidophenyl)-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(4-acetamidophenyl)-2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C21H20N4O3S MolecularWeight: 408.4735

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C21H20N4O3S/c1-3-12-25-20(28)17-6-4-5-7-18(17)24-21(25)29-13-19(27)23-16-10-8-15(9-11-16)22-14(2)26/h3-11H,1,12-13H2,2H3,(H,22,26)(H,23,27)