4-fluoranyl-N'-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]sulfonylphenyl]carbonyl-benzohydrazide

Systemtic Name: 4-fluoranyl-N'-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]sulfonylphenyl]carbonyl-benzohydrazide Openeye Name: N'-[4-(4-benzylpiperazin-4-ium-1-yl)sulfonylbenzoyl]-4-fluoro-benzohydrazide CAS Name: 4-fluoro-N'-[oxo-[4-[[4-(phenylmethyl)-1-piperazin-4-iumyl]sulfonyl]phenyl]methyl]benzohydrazide IUPAC Name: N'-[4-(4-benzylpiperazin-4-ium-1-yl)sulfonylbenzoyl]-4-fluorobenzohydrazide Traditional Name: N'-[4-(4-benzylpiperazin-4-ium-1-yl)sulfonylbenzoyl]-4-fluoro-benzohydrazide Formula: C25H26FN4O4S+ MolecularWeight: 497.561743

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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=C(C=C4)F

Isomeric SMILES

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

InChI

InChI=1S/C25H25FN4O4S/c26-22-10-6-20(7-11-22)24(31)27-28-25(32)21-8-12-23(13-9-21)35(33,34)30-16-14-29(15-17-30)18-19-4-2-1-3-5-19/h1-13H,14-18H2,(H,27,31)(H,28,32)/p+1