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

Systemtic Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N'-[(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]ethanehydrazide Openeye Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N'-[(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]acetohydrazide CAS Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N'-[(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]acetohydrazide IUPAC Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N'-[(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]acetohydrazide Traditional Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N'-[(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]acetohydrazide Formula: C16H15N4O3S+ MolecularWeight: 343.3803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[NH+]2)SCC(=O)NNC=C3C=CC(=O)C(=C3)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[NH+]2)SCC(=O)NNC=C3C=CC(=O)C(=C3)O

InChI

InChI=1S/C16H14N4O3S/c21-13-6-5-10(7-14(13)22)8-17-20-15(23)9-24-16-18-11-3-1-2-4-12(11)19-16/h1-8,17,22H,9H2,(H,18,19)(H,20,23)/p+1