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

Systemtic Name: (3S)-1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonyl-N-pyridin-3-yl-piperidine-3-carboxamide Openeye Name: (3S)-1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyl-N-(3-pyridyl)piperidine-3-carboxamide CAS Name: (3S)-1-[4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonyl-N-(3-pyridinyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyl-N-pyridin-3-ylpiperidine-3-carboxamide Traditional Name: (3S)-1-[4-(2-ketopyrrolidino)phenyl]sulfonyl-N-(3-pyridyl)nipecotamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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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)NC4=CN=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)C(=O)NC4=CN=CC=C4

InChI

InChI=1S/C21H24N4O4S/c26-20-6-3-13-25(20)18-7-9-19(10-8-18)30(28,29)24-12-2-4-16(15-24)21(27)23-17-5-1-11-22-14-17/h1,5,7-11,14,16H,2-4,6,12-13,15H2,(H,23,27)/t16-/m0/s1