2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N'-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]propanehydrazide

Systemtic Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N'-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]propanehydrazide Openeye Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N'-[(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]propanehydrazide CAS Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N'-[(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]propanehydrazide IUPAC Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N'-[(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]propanehydrazide Traditional Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N'-[(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]propionohydrazide Formula: C17H17N4O3S+ MolecularWeight: 357.40688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC=C1C=CC(=O)C=C1O)SC2=[NH+]C3=CC=CC=C3N2

Isomeric SMILES

CC(C(=O)NNC=C1C=CC(=O)C=C1O)SC2=[NH+]C3=CC=CC=C3N2

InChI

InChI=1S/C17H16N4O3S/c1-10(25-17-19-13-4-2-3-5-14(13)20-17)16(24)21-18-9-11-6-7-12(22)8-15(11)23/h2-10,18,23H,1H3,(H,19,20)(H,21,24)/p+1