5-[(4,7-dimethoxy-1H-benzimidazol-2-yl)sulfanyl]-8-nitro-quinoline

Systemtic Name: 5-[(4,7-dimethoxy-1H-benzimidazol-2-yl)sulfanyl]-8-nitro-quinoline Openeye Name: 5-[(4,7-dimethoxy-1H-benzimidazol-2-yl)sulfanyl]-8-nitro-quinoline CAS Name: 5-[(4,7-dimethoxy-1H-benzimidazol-2-yl)thio]-8-nitroquinoline IUPAC Name: 5-[(4,7-dimethoxy-1H-benzimidazol-2-yl)sulfanyl]-8-nitroquinoline Traditional Name: 5-[(4,7-dimethoxy-1H-benzimidazol-2-yl)thio]-8-nitro-quinoline Formula: C18H14N4O4S MolecularWeight: 382.39316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)N=C(N2)SC3=C4C=CC=NC4=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)N=C(N2)SC3=C4C=CC=NC4=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O4S/c1-25-12-6-7-13(26-2)17-16(12)20-18(21-17)27-14-8-5-11(22(23)24)15-10(14)4-3-9-19-15/h3-9H,1-2H3,(H,20,21)