1-[(2-methylphenyl)methylsulfonyl]-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-[(2-methylphenyl)methylsulfonyl]-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(o-tolylmethylsulfonyl)-N-[[4-(1-piperidyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-[(2-methylphenyl)methylsulfonyl]-N-[[4-(1-piperidinyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2-methylphenyl)methylsulfonyl]-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(2-methylbenzyl)sulfonyl-N-(4-piperidinobenzyl)isonipecotamide Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C26H35N3O3S/c1-21-7-3-4-8-24(21)20-33(31,32)29-17-13-23(14-18-29)26(30)27-19-22-9-11-25(12-10-22)28-15-5-2-6-16-28/h3-4,7-12,23H,2,5-6,13-20H2,1H3,(H,27,30)