N-[4-[1-(4-pyridin-3-ylbutyl)piperidin-4-yl]carbonylphenyl]methanesulfonamide

Systemtic Name: N-[4-[1-(4-pyridin-3-ylbutyl)piperidin-4-yl]carbonylphenyl]methanesulfonamide Openeye Name: N-[4-[1-[4-(3-pyridyl)butyl]piperidine-4-carbonyl]phenyl]methanesulfonamide CAS Name: N-[4-[oxo-[1-[4-(3-pyridinyl)butyl]-4-piperidinyl]methyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[1-(4-pyridin-3-ylbutyl)piperidine-4-carbonyl]phenyl]methanesulfonamide Traditional Name: N-[4-[1-[4-(3-pyridyl)butyl]isonipecotoyl]phenyl]methanesulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCCCC3=CN=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCCCC3=CN=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-29(27,28)24-21-9-7-19(8-10-21)22(26)20-11-15-25(16-12-20)14-3-2-5-18-6-4-13-23-17-18/h4,6-10,13,17,20,24H,2-3,5,11-12,14-16H2,1H3