N-methyl-3-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxamide

Systemtic Name: N-methyl-3-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxamide Openeye Name: N-methyl-3-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxamide CAS Name: N-methyl-3-[[(1-methyl-2-imidazolyl)thio]methyl]-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxamide IUPAC Name: N-methyl-3-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxido-1-oxoquinoxalin-1-ium-2-carboxamide Traditional Name: 1-keto-N-methyl-3-[[(1-methylimidazol-2-yl)thio]methyl]-4-oxido-quinoxalin-1-ium-2-carboxamide Formula: C15H15N5O3S MolecularWeight: 345.3763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(N(C2=CC=CC=C2[N+]1=O)[O-])CSC3=NC=CN3C

Isomeric SMILES

CNC(=O)C1=C(N(C2=CC=CC=C2[N+]1=O)[O-])CSC3=NC=CN3C

InChI

InChI=1S/C15H15N5O3S/c1-16-14(21)13-12(9-24-15-17-7-8-18(15)2)19(22)10-5-3-4-6-11(10)20(13)23/h3-8H,9H2,1-2H3,(H,16,21)