N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-oxidanylidenebenzo[g]quinazolin-3-yl)ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-oxidanylidenebenzo[g]quinazolin-3-yl)ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-oxobenzo[g]quinazolin-3-yl)acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-(4-oxo-3-benzo[g]quinazolinyl)acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-oxobenzo[g]quinazolin-3-yl)acetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-(4-ketobenzo[g]quinazolin-3-yl)acetamide Formula: C22H16N4O2S MolecularWeight: 400.45304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C(=CC2=C1)C(=O)N(C=N3)CC(=O)NC4=CC=CC=C4SCC#N

Isomeric SMILES

C1=CC=C2C=C3C(=CC2=C1)C(=O)N(C=N3)CC(=O)NC4=CC=CC=C4SCC#N

InChI

InChI=1S/C22H16N4O2S/c23-9-10-29-20-8-4-3-7-18(20)25-21(27)13-26-14-24-19-12-16-6-2-1-5-15(16)11-17(19)22(26)28/h1-8,11-12,14H,10,13H2,(H,25,27)