1-(phenylsulfonyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperidine-2-carboxamide

Systemtic Name: 1-(phenylsulfonyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]-2-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperidine-2-carboxamide Traditional Name: 1-besyl-N-[2-(pyrrolidinomethyl)benzyl]pipecolinamide Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NCC2=CC=CC=C2CN3CCCC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)C(=O)NCC2=CC=CC=C2CN3CCCC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H31N3O3S/c28-24(25-18-20-10-4-5-11-21(20)19-26-15-8-9-16-26)23-14-6-7-17-27(23)31(29,30)22-12-2-1-3-13-22/h1-5,10-13,23H,6-9,14-19H2,(H,25,28)