N'-(3-cyclopentylpropanoyl)-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]sulfonyl-benzohydrazide

Systemtic Name: N'-(3-cyclopentylpropanoyl)-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]sulfonyl-benzohydrazide Openeye Name: 4-(4-benzylpiperazin-4-ium-1-yl)sulfonyl-N'-(3-cyclopentylpropanoyl)benzohydrazide CAS Name: N'-(3-cyclopentyl-1-oxopropyl)-4-[[4-(phenylmethyl)-1-piperazin-4-iumyl]sulfonyl]benzohydrazide IUPAC Name: 4-(4-benzylpiperazin-4-ium-1-yl)sulfonyl-N'-(3-cyclopentylpropanoyl)benzohydrazide Traditional Name: 4-(4-benzylpiperazin-4-ium-1-yl)sulfonyl-N'-(3-cyclopentylpropanoyl)benzohydrazide Formula: C26H35N4O4S+ MolecularWeight: 499.6455

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)CCC(=O)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H34N4O4S/c31-25(15-10-21-6-4-5-7-21)27-28-26(32)23-11-13-24(14-12-23)35(33,34)30-18-16-29(17-19-30)20-22-8-2-1-3-9-22/h1-3,8-9,11-14,21H,4-7,10,15-20H2,(H,27,31)(H,28,32)/p+1