N'-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2-[[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanehydrazide

Systemtic Name: N'-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2-[[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanehydrazide Openeye Name: N'-[(5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-2-[[3-(p-tolylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]acetohydrazide CAS Name: N'-[(5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-2-[[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]thio]acetohydrazide IUPAC Name: N'-[(5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-2-[[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]sulfanyl]acetohydrazide Traditional Name: N'-[(6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methyl]-2-[[3-(4-methylbenzyl)-1H-benzimidazol-3-ium-2-yl]thio]acetohydrazide Formula: C25H25N4O3S+ MolecularWeight: 461.556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)SCC(=O)NNC=C4C=CC=C(C4=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)SCC(=O)NNC=C4C=CC=C(C4=O)OC

InChI

InChI=1S/C25H24N4O3S/c1-17-10-12-18(13-11-17)15-29-21-8-4-3-7-20(21)27-25(29)33-16-23(30)28-26-14-19-6-5-9-22(32-2)24(19)31/h3-14H,15-16H2,1-2H3,(H2,26,28,30,31)/p+1