4-bromanyl-N'-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]benzohydrazide

Systemtic Name: 4-bromanyl-N'-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]benzohydrazide Openeye Name: 4-bromo-N'-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]benzohydrazide CAS Name: 4-bromo-N'-[2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-oxoethyl]benzohydrazide IUPAC Name: 4-bromo-N'-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]benzohydrazide Traditional Name: 4-bromo-N'-[2-[(1-oxidopyridin-1-ium-2-yl)thio]acetyl]benzohydrazide Formula: C14H12BrN3O3S MolecularWeight: 382.23238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC(=O)NNC(=O)C2=CC=C(C=C2)Br)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCC(=O)NNC(=O)C2=CC=C(C=C2)Br)[O-]

InChI

InChI=1S/C14H12BrN3O3S/c15-11-6-4-10(5-7-11)14(20)17-16-12(19)9-22-13-3-1-2-8-18(13)21/h1-8H,9H2,(H,16,19)(H,17,20)