(3R)-N-[3-oxidanylidene-3-(pyridin-2-ylamino)propyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3R)-N-[3-oxidanylidene-3-(pyridin-2-ylamino)propyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3R)-1-(benzenesulfonyl)-N-[3-oxo-3-(2-pyridylamino)propyl]piperidine-3-carboxamide CAS Name: (3R)-1-(benzenesulfonyl)-N-[3-oxo-3-(2-pyridinylamino)propyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(benzenesulfonyl)-N-[3-oxo-3-(pyridin-2-ylamino)propyl]piperidine-3-carboxamide Traditional Name: (3R)-1-besyl-N-[3-keto-3-(2-pyridylamino)propyl]nipecotamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCCC(=O)NC3=CC=CC=N3

Isomeric SMILES

C1C[C@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCCC(=O)NC3=CC=CC=N3

InChI

InChI=1S/C20H24N4O4S/c25-19(23-18-10-4-5-12-21-18)11-13-22-20(26)16-7-6-14-24(15-16)29(27,28)17-8-2-1-3-9-17/h1-5,8-10,12,16H,6-7,11,13-15H2,(H,22,26)(H,21,23,25)/t16-/m1/s1