4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-(phenylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-(phenylmethyl)piperazine-1-carboxamide Openeye Name: N-benzyl-4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-piperazine-1-carboxamide CAS Name: 4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-N-(phenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-benzyl-4-(4-methylpiperazin-4-ium-1-yl)sulfonylpiperazine-1-carboxamide Traditional Name: N-benzyl-4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-piperazine-1-carboxamide Formula: C17H28N5O3S+ MolecularWeight: 382.50092

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C17H27N5O3S/c1-19-7-11-21(12-8-19)26(24,25)22-13-9-20(10-14-22)17(23)18-15-16-5-3-2-4-6-16/h2-6H,7-15H2,1H3,(H,18,23)/p+1