1-methyl-2-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)sulfanyl-benzimidazole

Systemtic Name: 1-methyl-2-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)sulfanyl-benzimidazole Openeye Name: 1-methyl-2-[2-nitro-4-(1-piperidylsulfonyl)phenyl]sulfanyl-benzimidazole CAS Name: 1-methyl-2-[[2-nitro-4-(1-piperidinylsulfonyl)phenyl]thio]benzimidazole IUPAC Name: 1-methyl-2-(2-nitro-4-piperidin-1-ylsulfonylphenyl)sulfanylbenzimidazole Traditional Name: 1-methyl-2-[(2-nitro-4-piperidinosulfonyl-phenyl)thio]benzimidazole Formula: C19H20N4O4S2 MolecularWeight: 432.5165

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O4S2/c1-21-16-8-4-3-7-15(16)20-19(21)28-18-10-9-14(13-17(18)23(24)25)29(26,27)22-11-5-2-6-12-22/h3-4,7-10,13H,2,5-6,11-12H2,1H3