N-(1H-benzimidazol-2-yl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1H-benzimidazol-2-yl)-2-[(5-nitro-2-pyridyl)sulfanyl]acetamide CAS Name: N-(1H-benzimidazol-2-yl)-2-[(5-nitro-2-pyridinyl)thio]acetamide IUPAC Name: N-(1H-benzimidazol-2-yl)-2-(5-nitropyridin-2-yl)sulfanylacetamide Traditional Name: N-(1H-benzimidazol-2-yl)-2-[(5-nitro-2-pyridyl)thio]acetamide Formula: C14H11N5O3S MolecularWeight: 329.33384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)NC(=O)CSC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)NC(=O)CSC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O3S/c20-12(8-23-13-6-5-9(7-15-13)19(21)22)18-14-16-10-3-1-2-4-11(10)17-14/h1-7H,8H2,(H2,16,17,18,20)