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

Systemtic Name: N-[4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]phenyl]ethanamide Openeye Name: N-[4-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]phenyl]acetamide CAS Name: N-[4-[(4-oxo-1,2,3-benzotriazin-3-yl)methylthio]phenyl]acetamide IUPAC Name: N-[4-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]phenyl]acetamide Traditional Name: N-[4-[(4-keto-1,2,3-benzotriazin-3-yl)methylthio]phenyl]acetamide Formula: C16H14N4O2S MolecularWeight: 326.37296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H14N4O2S/c1-11(21)17-12-6-8-13(9-7-12)23-10-20-16(22)14-4-2-3-5-15(14)18-19-20/h2-9H,10H2,1H3,(H,17,21)