(3S)-N-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-[2-oxo-2-(2-thienylmethylamino)ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-[2-keto-2-(2-thenylamino)ethyl]nipecotamide Formula: C19H23N3O4S2 MolecularWeight: 421.53362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC(=O)NCC3=CC=CS3

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C19H23N3O4S2/c23-18(20-12-16-7-5-11-27-16)13-21-19(24)15-6-4-10-22(14-15)28(25,26)17-8-2-1-3-9-17/h1-3,5,7-9,11,15H,4,6,10,12-14H2,(H,20,23)(H,21,24)/t15-/m0/s1