4-[2-(1-methyl-2,3-dihydropyrazino[2,3-b]quinoxalin-4-yl)-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-(1-methyl-2,3-dihydropyrazino[2,3-b]quinoxalin-4-yl)-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-(1-methyl-2,3-dihydropyrazino[2,3-b]quinoxalin-4-yl)-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-(1-methyl-2,3-dihydropyrazino[2,3-b]quinoxalin-4-yl)-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-(1-methyl-2,3-dihydropyrazino[2,3-b]quinoxalin-4-yl)-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-keto-2-(1-methyl-2,3-dihydropyrazino[2,3-b]quinoxalin-4-yl)ethyl]thio]-3-nitro-benzamide Formula: C20H18N6O4S MolecularWeight: 438.45972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C2=NC3=CC=CC=C3N=C21)C(=O)CSC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(C2=NC3=CC=CC=C3N=C21)C(=O)CSC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C20H18N6O4S/c1-24-8-9-25(20-19(24)22-13-4-2-3-5-14(13)23-20)17(27)11-31-16-7-6-12(18(21)28)10-15(16)26(29)30/h2-7,10H,8-9,11H2,1H3,(H2,21,28)