2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N'-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]ethanehydrazide

Systemtic Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N'-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]ethanehydrazide Openeye Name: N'-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]acetohydrazide CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]-N'-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]acetohydrazide IUPAC Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N'-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]acetohydrazide Traditional Name: N'-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-2-(4-tosylpiperazin-1-ium-1-yl)acetohydrazide Formula: C20H25N4O4S+ MolecularWeight: 417.5019

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NNC=C3C=CC(=O)C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NNC=C3C=CC(=O)C=C3

InChI

InChI=1S/C20H24N4O4S/c1-16-2-8-19(9-3-16)29(27,28)24-12-10-23(11-13-24)15-20(26)22-21-14-17-4-6-18(25)7-5-17/h2-9,14,21H,10-13,15H2,1H3,(H,22,26)/p+1