N-(3-imidazol-1-ylpropyl)-6-methyl-2-[1-(2-methyl-3-oxidanyl-phenyl)carbonylpiperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-6-methyl-2-[1-(2-methyl-3-oxidanyl-phenyl)carbonylpiperidin-4-yl]pyridine-3-carboxamide Openeye Name: 2-[1-(3-hydroxy-2-methyl-benzoyl)-4-piperidyl]-N-(3-imidazol-1-ylpropyl)-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-[(3-hydroxy-2-methylphenyl)-oxomethyl]-4-piperidinyl]-N-[3-(1-imidazolyl)propyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-(3-hydroxy-2-methylbenzoyl)piperidin-4-yl]-N-(3-imidazol-1-ylpropyl)-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-(3-hydroxy-2-methyl-benzoyl)-4-piperidyl]-N-(3-imidazol-1-ylpropyl)-6-methyl-nicotinamide Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)C4=C(C(=CC=C4)O)C

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)C4=C(C(=CC=C4)O)C

InChI

InChI=1S/C26H31N5O3/c1-18-7-8-22(25(33)28-11-4-13-30-16-12-27-17-30)24(29-18)20-9-14-31(15-10-20)26(34)21-5-3-6-23(32)19(21)2/h3,5-8,12,16-17,20,32H,4,9-11,13-15H2,1-2H3,(H,28,33)