N-[3,5-bis(bromanyl)pyridin-2-yl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[3,5-bis(bromanyl)pyridin-2-yl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-(3,5-dibromo-2-pyridyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-(3,5-dibromo-2-pyridinyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-(3,5-dibromopyridin-2-yl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-(3,5-dibromo-2-pyridyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C15H13Br2N4OS+ MolecularWeight: 457.16292

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)NC3=C(C=C(C=N3)Br)Br

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)NC3=C(C=C(C=N3)Br)Br

InChI

InChI=1S/C15H12Br2N4OS/c1-21-12-5-3-2-4-11(12)19-15(21)23-8-13(22)20-14-10(17)6-9(16)7-18-14/h2-7H,8H2,1H3,(H,18,20,22)/p+1