N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-isopropylphenyl)sulfonyl-N-[[2-(1-piperidylmethyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: N-[[2-(1-piperidinylmethyl)phenyl]methyl]-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-p-cumenylsulfonyl-N-[2-(piperidinomethyl)benzyl]isonipecotamide Formula: C28H39N3O3S MolecularWeight: 497.69256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3CN4CCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3CN4CCCCC4

InChI

InChI=1S/C28H39N3O3S/c1-22(2)23-10-12-27(13-11-23)35(33,34)31-18-14-24(15-19-31)28(32)29-20-25-8-4-5-9-26(25)21-30-16-6-3-7-17-30/h4-5,8-13,22,24H,3,6-7,14-21H2,1-2H3,(H,29,32)