1-[(4-methylphenyl)methylsulfonyl]-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-[(4-methylphenyl)methylsulfonyl]-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide Openeye Name: N-[3-(4-methylpiperazin-1-yl)propyl]-1-(p-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: 1-[(4-methylphenyl)methylsulfonyl]-N-[3-(4-methyl-1-piperazinyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[(4-methylphenyl)methylsulfonyl]-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide Traditional Name: 1-(4-methylbenzyl)sulfonyl-N-[3-(4-methylpiperazino)propyl]isonipecotamide Formula: C22H36N4O3S MolecularWeight: 436.61124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NCCCN3CCN(CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NCCCN3CCN(CC3)C

InChI

InChI=1S/C22H36N4O3S/c1-19-4-6-20(7-5-19)18-30(28,29)26-12-8-21(9-13-26)22(27)23-10-3-11-25-16-14-24(2)15-17-25/h4-7,21H,3,8-18H2,1-2H3,(H,23,27)