6-methyl-2-(3-nitropyridin-2-yl)sulfanyl-1H-benzimidazole

Systemtic Name: 6-methyl-2-(3-nitropyridin-2-yl)sulfanyl-1H-benzimidazole Openeye Name: 6-methyl-2-[(3-nitro-2-pyridyl)sulfanyl]-1H-benzimidazole CAS Name: 6-methyl-2-[(3-nitro-2-pyridinyl)thio]-1H-benzimidazole IUPAC Name: 6-methyl-2-(3-nitropyridin-2-yl)sulfanyl-1H-benzimidazole Traditional Name: 6-methyl-2-[(3-nitro-2-pyridyl)thio]-1H-benzimidazole Formula: C13H10N4O2S MolecularWeight: 286.3091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O2S/c1-8-4-5-9-10(7-8)16-13(15-9)20-12-11(17(18)19)3-2-6-14-12/h2-7H,1H3,(H,15,16)