N'-(phenylcarbonyl)-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]sulfonyl-benzohydrazide

Systemtic Name: N'-(phenylcarbonyl)-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]sulfonyl-benzohydrazide Openeye Name: N'-benzoyl-4-(4-benzylpiperazin-4-ium-1-yl)sulfonyl-benzohydrazide CAS Name: N'-benzoyl-4-[[4-(phenylmethyl)-1-piperazin-4-iumyl]sulfonyl]benzohydrazide IUPAC Name: N'-benzoyl-4-(4-benzylpiperazin-4-ium-1-yl)sulfonylbenzohydrazide Traditional Name: N'-benzoyl-4-(4-benzylpiperazin-4-ium-1-yl)sulfonyl-benzohydrazide Formula: C25H27N4O4S+ MolecularWeight: 479.57128

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(=O)NNC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(=O)NNC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4O4S/c30-24(21-9-5-2-6-10-21)26-27-25(31)22-11-13-23(14-12-22)34(32,33)29-17-15-28(16-18-29)19-20-7-3-1-4-8-20/h1-14H,15-19H2,(H,26,30)(H,27,31)/p+1