3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C16H13N5O2S MolecularWeight: 339.37172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H13N5O2S/c1-23-10-6-7-13-14(8-10)18-16(17-13)24-9-21-15(22)11-4-2-3-5-12(11)19-20-21/h2-8H,9H2,1H3,(H,17,18)