N-[4-[[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methylsulfanyl]phenyl]ethanamide

Systemtic Name: N-[4-[[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methylsulfanyl]phenyl]ethanamide Openeye Name: N-[4-[[3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methylsulfanyl]phenyl]acetamide CAS Name: N-[4-[[3-(cyanomethyl)-4-oxo-2-quinazolinyl]methylthio]phenyl]acetamide IUPAC Name: N-[4-[[3-(cyanomethyl)-4-oxoquinazolin-2-yl]methylsulfanyl]phenyl]acetamide Traditional Name: N-[4-[[3-(cyanomethyl)-4-keto-quinazolin-2-yl]methylthio]phenyl]acetamide Formula: C19H16N4O2S MolecularWeight: 364.42094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC2=NC3=CC=CC=C3C(=O)N2CC#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC2=NC3=CC=CC=C3C(=O)N2CC#N

InChI

InChI=1S/C19H16N4O2S/c1-13(24)21-14-6-8-15(9-7-14)26-12-18-22-17-5-3-2-4-16(17)19(25)23(18)11-10-20/h2-9H,11-12H2,1H3,(H,21,24)