6-nitro-2-(pyridin-2-ylsulfinylmethyl)-1H-benzimidazole

Systemtic Name: 6-nitro-2-(pyridin-2-ylsulfinylmethyl)-1H-benzimidazole Openeye Name: 6-nitro-2-(2-pyridylsulfinylmethyl)-1H-benzimidazole CAS Name: 6-nitro-2-(2-pyridinylsulfinylmethyl)-1H-benzimidazole IUPAC Name: 6-nitro-2-(pyridin-2-ylsulfinylmethyl)-1H-benzimidazole Traditional Name: 6-nitro-2-(2-pyridylsulfinylmethyl)-1H-benzimidazole Formula: C13H10N4O3S MolecularWeight: 302.3085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)S(=O)CC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)S(=O)CC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O3S/c18-17(19)9-4-5-10-11(7-9)16-12(15-10)8-21(20)13-3-1-2-6-14-13/h1-7H,8H2,(H,15,16)