N-(5-chloranyl-2-piperidin-1-yl-phenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[5-chloro-2-(1-piperidyl)phenyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[5-chloro-2-(1-piperidinyl)phenyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-piperidin-1-ylphenyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(5-chloro-2-piperidino-phenyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C22H27ClN4O3S MolecularWeight: 462.99278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H27ClN4O3S/c23-18-6-7-21(26-11-2-1-3-12-26)20(15-18)25-22(28)17-8-13-27(14-9-17)31(29,30)19-5-4-10-24-16-19/h4-7,10,15-17H,1-3,8-9,11-14H2,(H,25,28)