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

Systemtic Name: N-(2-cyanoethyl)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-phenyl-acetamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C22H22N4O2S/c1-16(2)26-21(28)18-11-6-7-12-19(18)24-22(26)29-15-20(27)25(14-8-13-23)17-9-4-3-5-10-17/h3-7,9-12,16H,8,14-15H2,1-2H3