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

Systemtic Name: 2-(3-nitropyridin-2-yl)sulfanyl-1H-benzimidazole Openeye Name: 2-[(3-nitro-2-pyridyl)sulfanyl]-1H-benzimidazole CAS Name: 2-[(3-nitro-2-pyridinyl)thio]-1H-benzimidazole IUPAC Name: 2-(3-nitropyridin-2-yl)sulfanyl-1H-benzimidazole Traditional Name: 2-[(3-nitro-2-pyridyl)thio]-1H-benzimidazole Formula: C12H8N4O2S MolecularWeight: 272.28252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C12H8N4O2S/c17-16(18)10-6-3-7-13-11(10)19-12-14-8-4-1-2-5-9(8)15-12/h1-7H,(H,14,15)