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

Systemtic Name: 6-methyl-N-(3-methylbutyl)-2-[1-(phenylsulfonyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: 2-[1-(benzenesulfonyl)-4-piperidyl]-N-isopentyl-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-(benzenesulfonyl)-4-piperidinyl]-6-methyl-N-(3-methylbutyl)-3-pyridinecarboxamide IUPAC Name: 2-[1-(benzenesulfonyl)piperidin-4-yl]-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide Traditional Name: 2-(1-besyl-4-piperidyl)-N-isoamyl-6-methyl-nicotinamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O3S/c1-17(2)11-14-24-23(27)21-10-9-18(3)25-22(21)19-12-15-26(16-13-19)30(28,29)20-7-5-4-6-8-20/h4-10,17,19H,11-16H2,1-3H3,(H,24,27)