1-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-N'-pyridin-2-yl-pyridin-1-ium-3-carbohydrazide bromide

Systemtic Name: 1-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-N'-pyridin-2-yl-pyridin-1-ium-3-carbohydrazide bromide Openeye Name: 1-[2-oxo-2-(2-thienyl)ethyl]-N'-(2-pyridyl)pyridin-1-ium-3-carbohydrazide bromide CAS Name: 1-(2-oxo-2-thiophen-2-ylethyl)-N'-(2-pyridinyl)-3-pyridin-1-iumcarbohydrazide bromide IUPAC Name: 1-(2-oxo-2-thiophen-2-ylethyl)-N'-pyridin-2-ylpyridin-1-ium-3-carbohydrazide bromide Traditional Name: 1-[2-keto-2-(2-thienyl)ethyl]-N'-(2-pyridyl)pyridin-1-ium-3-carbohydrazide bromide Formula: C17H15BrN4O2S MolecularWeight: 419.2956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NNC(=O)C2=C[N+](=CC=C2)CC(=O)C3=CC=CS3.[Br-]

Isomeric SMILES

C1=CC=NC(=C1)NNC(=O)C2=C[N+](=CC=C2)CC(=O)C3=CC=CS3.[Br-]

InChI

InChI=1S/C17H14N4O2S.BrH/c22-14(15-6-4-10-24-15)12-21-9-3-5-13(11-21)17(23)20-19-16-7-1-2-8-18-16;/h1-11H,12H2,(H-,18,19,20,23);1H