N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-(4-keto-1,2,3-benzotriazin-3-yl)acetamide Formula: C17H13N5O2S MolecularWeight: 351.38242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CC(=O)NC3=CC=CC=C3SCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CC(=O)NC3=CC=CC=C3SCC#N

InChI

InChI=1S/C17H13N5O2S/c18-9-10-25-15-8-4-3-7-14(15)19-16(23)11-22-17(24)12-5-1-2-6-13(12)20-21-22/h1-8H,10-11H2,(H,19,23)