N-methyl-1-(4-methylphenyl)sulfonyl-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-methyl-1-(4-methylphenyl)sulfonyl-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-methyl-N-[[4-(1-piperidyl)phenyl]methyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-methyl-1-(4-methylphenyl)sulfonyl-N-[[4-(1-piperidinyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-1-(4-methylphenyl)sulfonyl-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-methyl-N-(4-piperidinobenzyl)-1-tosyl-isonipecotamide Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C26H35N3O3S/c1-21-6-12-25(13-7-21)33(31,32)29-18-14-23(15-19-29)26(30)27(2)20-22-8-10-24(11-9-22)28-16-4-3-5-17-28/h6-13,23H,3-5,14-20H2,1-2H3