2-[4-(4-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-[4-(4-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[4-(4-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]acetamide CAS Name: 2-[4-(4-cyanophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[4-(4-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[4-(4-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]acetamide Formula: C25H39N5O3S+2 MolecularWeight: 489.67386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N)[NH+]4CCCCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N)[NH+]4CCCCC4

InChI

InChI=1S/C25H37N5O3S/c26-19-22-7-9-23(10-8-22)34(32,33)30-17-15-28(16-18-30)20-24(31)27-21-25(11-3-1-4-12-25)29-13-5-2-6-14-29/h7-10H,1-6,11-18,20-21H2,(H,27,31)/p+2