(3S)-1-(4-chlorophenyl)sulfonyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]nipecotamide Formula: C24H32ClN4O3S+ MolecularWeight: 492.05388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)[C@H]3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H31ClN4O3S/c1-18-16-21(28-14-12-27(2)13-15-28)7-10-23(18)26-24(30)19-4-3-11-29(17-19)33(31,32)22-8-5-20(25)6-9-22/h5-10,16,19H,3-4,11-15,17H2,1-2H3,(H,26,30)/p+1/t19-/m0/s1