1-[(3-methylphenyl)methylsulfonyl]-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-methylphenyl)methylsulfonyl]-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(m-tolylmethylsulfonyl)-N-[[4-(1-piperidyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-[(3-methylphenyl)methylsulfonyl]-N-[[4-(1-piperidinyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-methylphenyl)methylsulfonyl]-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(3-methylbenzyl)sulfonyl-N-(4-piperidinobenzyl)isonipecotamide Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C26H35N3O3S/c1-21-6-5-7-23(18-21)20-33(31,32)29-16-12-24(13-17-29)26(30)27-19-22-8-10-25(11-9-22)28-14-3-2-4-15-28/h5-11,18,24H,2-4,12-17,19-20H2,1H3,(H,27,30)