(3R)-1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonyl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide

Systemtic Name: (3R)-1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonyl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide Openeye Name: (3R)-1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyl-N-(3-pyridylmethyl)piperidine-3-carboxamide CAS Name: (3R)-1-[4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonyl-N-(3-pyridinylmethyl)-3-piperidinecarboxamide IUPAC Name: (3R)-1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide Traditional Name: (3R)-1-[4-(2-ketopyrrolidino)phenyl]sulfonyl-N-(3-pyridylmethyl)nipecotamide Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1C[C@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C22H26N4O4S/c27-21-6-3-13-26(21)19-7-9-20(10-8-19)31(29,30)25-12-2-5-18(16-25)22(28)24-15-17-4-1-11-23-14-17/h1,4,7-11,14,18H,2-3,5-6,12-13,15-16H2,(H,24,28)/t18-/m1/s1