N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-yl]ethyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-[4-(m-tolyl)piperazino]ethyl]-1-tosyl-isonipecotamide Formula: C26H36N4O3S MolecularWeight: 484.65404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCN3CCN(CC3)C4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCN3CCN(CC3)C4=CC=CC(=C4)C

InChI

InChI=1S/C26H36N4O3S/c1-21-6-8-25(9-7-21)34(32,33)30-13-10-23(11-14-30)26(31)27-12-15-28-16-18-29(19-17-28)24-5-3-4-22(2)20-24/h3-9,20,23H,10-19H2,1-2H3,(H,27,31)