[3-chloranyl-7-(1H-imidazol-2-ylsulfanyl)-6-nitro-3,4-dihydroquinoxalin-2-yl]cyanamide

Systemtic Name: [3-chloranyl-7-(1H-imidazol-2-ylsulfanyl)-6-nitro-3,4-dihydroquinoxalin-2-yl]cyanamide Openeye Name: [3-chloro-7-(1H-imidazol-2-ylsulfanyl)-6-nitro-3,4-dihydroquinoxalin-2-yl]cyanamide CAS Name: [3-chloro-7-(1H-imidazol-2-ylthio)-6-nitro-3,4-dihydroquinoxalin-2-yl]cyanamide IUPAC Name: [3-chloro-7-(1H-imidazol-2-ylsulfanyl)-6-nitro-3,4-dihydroquinoxalin-2-yl]cyanamide Traditional Name: [3-chloro-7-(1H-imidazol-2-ylthio)-6-nitro-3,4-dihydroquinoxalin-2-yl]cyanamide Formula: C12H8ClN7O2S MolecularWeight: 349.75562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N1)SC2=C(C=C3C(=C2)N=C(C(N3)Cl)NC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CN=C(N1)SC2=C(C=C3C(=C2)N=C(C(N3)Cl)NC#N)[N+](=O)[O-]

InChI

InChI=1S/C12H8ClN7O2S/c13-10-11(17-5-14)19-7-4-9(23-12-15-1-2-16-12)8(20(21)22)3-6(7)18-10/h1-4,10,18H,(H,15,16)(H,17,19)