(2S)-1-(phenylsulfonyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)piperidine-2-carboxamide

Systemtic Name: (2S)-1-(phenylsulfonyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)piperidine-2-carboxamide Openeye Name: (2S)-1-(benzenesulfonyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)piperidine-2-carboxamide CAS Name: (2S)-1-(benzenesulfonyl)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]-2-piperidinecarboxamide IUPAC Name: (2S)-1-(benzenesulfonyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)piperidine-2-carboxamide Traditional Name: (2S)-1-besyl-N-(3-pyrrolidinosulfonylphenyl)pipecolinamide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN([C@@H](C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H27N3O5S2/c26-22(21-13-4-5-16-25(21)32(29,30)19-10-2-1-3-11-19)23-18-9-8-12-20(17-18)31(27,28)24-14-6-7-15-24/h1-3,8-12,17,21H,4-7,13-16H2,(H,23,26)/t21-/m0/s1