6-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethoxy]-3-nitro-imidazo[1,2-b]pyridazine

Systemtic Name: 6-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethoxy]-3-nitro-imidazo[1,2-b]pyridazine Openeye Name: 6-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethoxy]-3-nitro-imidazo[1,2-b]pyridazine CAS Name: 6-[2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methylphenyl]thio]ethoxy]-3-nitroimidazo[1,2-b]pyridazine IUPAC Name: 6-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methylphenyl]sulfanylethoxy]-3-nitroimidazo[1,2-b]pyridazine Traditional Name: 6-[2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-phenyl]thio]ethoxy]-3-nitro-imidazo[1,2-b]pyridazine Formula: C23H20N6O3S2 MolecularWeight: 492.5733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCOC2=NN3C(=NC=C3[N+](=O)[O-])C=C2)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=C(C=CC=C1SCCOC2=NN3C(=NC=C3[N+](=O)[O-])C=C2)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C23H20N6O3S2/c1-15-16(14-34-23-25-17-6-2-3-7-18(17)26-23)5-4-8-19(15)33-12-11-32-21-10-9-20-24-13-22(29(30)31)28(20)27-21/h2-10,13H,11-12,14H2,1H3,(H,25,26)