(3Z)-6-oxidanylidene-3-[[2-[2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanoyl]hydrazinyl]methylidene]cyclohexa-1,4-dien-1-olate

Systemtic Name: (3Z)-6-oxidanylidene-3-[[2-[2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanoyl]hydrazinyl]methylidene]cyclohexa-1,4-dien-1-olate Openeye Name: (3Z)-3-[[2-[2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetyl]hydrazino]methylene]-6-oxo-cyclohexa-1,4-dien-1-olate CAS Name: (3Z)-6-oxo-3-[[[1-oxo-2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]thio]ethyl]hydrazo]methylidene]-1-cyclohexa-1,4-dienolate IUPAC Name: (3Z)-3-[[2-[2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetyl]hydrazinyl]methylidene]-6-oxocyclohexa-1,4-dien-1-olate Traditional Name: (3Z)-3-[[N'-[2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)thio]acetyl]hydrazino]methylene]-6-keto-cyclohexa-1,4-dien-1-olate Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)SCC(=O)NNC=C4C=CC(=O)C(=C4)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)SCC(=O)NN/C=C\4/C=CC(=O)C(=C4)[O-]

InChI

InChI=1S/C23H20N4O3S/c28-20-11-10-17(12-21(20)29)13-24-26-22(30)15-31-23-25-18-8-4-5-9-19(18)27(23)14-16-6-2-1-3-7-16/h1-13H,14-15H2,(H3,24,26,28,29,30)