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

Systemtic Name: N-(2-cyanoethyl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-phenylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(2-cyanoethyl)-N-phenyl-acetamide Formula: C22H20N4O2S MolecularWeight: 404.4848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C22H20N4O2S/c1-2-14-26-21(28)18-11-6-7-12-19(18)24-22(26)29-16-20(27)25(15-8-13-23)17-9-4-3-5-10-17/h2-7,9-12H,1,8,14-16H2