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

Systemtic Name: N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3-chloro-4-(2-ketopyrrolidino)phenyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C21H23ClN4O4S MolecularWeight: 462.94972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=C(C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4)Cl

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4)Cl

InChI

InChI=1S/C21H23ClN4O4S/c22-18-13-16(5-6-19(18)26-10-2-4-20(26)27)24-21(28)15-7-11-25(12-8-15)31(29,30)17-3-1-9-23-14-17/h1,3,5-6,9,13-15H,2,4,7-8,10-12H2,(H,24,28)