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

Systemtic Name: N-(2-cyanoethyl)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanyl-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]-N-phenyl-acetamide Formula: C25H20N4O2S MolecularWeight: 440.5169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(CCC#N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(CCC#N)C4=CC=CC=C4

InChI

InChI=1S/C25H20N4O2S/c26-16-9-17-28(19-10-3-1-4-11-19)23(30)18-32-25-27-22-15-8-7-14-21(22)24(31)29(25)20-12-5-2-6-13-20/h1-8,10-15H,9,17-18H2