1-oxidanidyl-N'-[4-[4-(phenylmethyl)piperazin-1-yl]sulfonylphenyl]carbonyl-pyridin-1-ium-3-carbohydrazide

Systemtic Name: 1-oxidanidyl-N'-[4-[4-(phenylmethyl)piperazin-1-yl]sulfonylphenyl]carbonyl-pyridin-1-ium-3-carbohydrazide Openeye Name: N'-[4-(4-benzylpiperazin-1-yl)sulfonylbenzoyl]-1-oxido-pyridin-1-ium-3-carbohydrazide CAS Name: 1-oxido-N'-[oxo-[4-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]phenyl]methyl]-3-pyridin-1-iumcarbohydrazide IUPAC Name: N'-[4-(4-benzylpiperazin-1-yl)sulfonylbenzoyl]-1-oxidopyridin-1-ium-3-carbohydrazide Traditional Name: N'-[4-(4-benzylpiperazino)sulfonylbenzoyl]-1-oxido-pyridin-1-ium-3-carbohydrazide Formula: C24H25N5O5S MolecularWeight: 495.5508

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(=O)NNC(=O)C4=C[N+](=CC=C4)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(=O)NNC(=O)C4=C[N+](=CC=C4)[O-]

InChI

InChI=1S/C24H25N5O5S/c30-23(25-26-24(31)21-7-4-12-28(32)18-21)20-8-10-22(11-9-20)35(33,34)29-15-13-27(14-16-29)17-19-5-2-1-3-6-19/h1-12,18H,13-17H2,(H,25,30)(H,26,31)