6-methyl-N-(2-methylpropyl)-2-[1-(phenylsulfonyl)piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: 6-methyl-N-(2-methylpropyl)-2-[1-(phenylsulfonyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: 2-[1-(benzenesulfonyl)-4-piperidyl]-N-isobutyl-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-(benzenesulfonyl)-4-piperidinyl]-6-methyl-N-(2-methylpropyl)-3-pyridinecarboxamide IUPAC Name: 2-[1-(benzenesulfonyl)piperidin-4-yl]-6-methyl-N-(2-methylpropyl)pyridine-3-carboxamide Traditional Name: 2-(1-besyl-4-piperidyl)-N-isobutyl-6-methyl-nicotinamide Formula: C22H29N3O3S MolecularWeight: 415.54896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCC(C)C)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCC(C)C)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

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