2-[(5-nitropyridin-2-yl)sulfinylmethyl]-1H-benzimidazole

Systemtic Name: 2-[(5-nitropyridin-2-yl)sulfinylmethyl]-1H-benzimidazole Openeye Name: 2-[(5-nitro-2-pyridyl)sulfinylmethyl]-1H-benzimidazole CAS Name: 2-[(5-nitro-2-pyridinyl)sulfinylmethyl]-1H-benzimidazole IUPAC Name: 2-[(5-nitropyridin-2-yl)sulfinylmethyl]-1H-benzimidazole Traditional Name: 2-[(5-nitro-2-pyridyl)sulfinylmethyl]-1H-benzimidazole Formula: C13H10N4O3S MolecularWeight: 302.3085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CS(=O)C3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CS(=O)C3=NC=C(C=C3)[N+](=O)[O-]

InChI

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