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

Systemtic Name: N-(3-imidazol-1-ylpropyl)-6-methyl-2-[1-(2-oxidanyl-4-phenyl-butanoyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: 2-[1-(2-hydroxy-4-phenyl-butanoyl)-4-piperidyl]-N-(3-imidazol-1-ylpropyl)-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-(2-hydroxy-1-oxo-4-phenylbutyl)-4-piperidinyl]-N-[3-(1-imidazolyl)propyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-(2-hydroxy-4-phenylbutanoyl)piperidin-4-yl]-N-(3-imidazol-1-ylpropyl)-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-(2-hydroxy-4-phenyl-butanoyl)-4-piperidyl]-N-(3-imidazol-1-ylpropyl)-6-methyl-nicotinamide Formula: C28H35N5O3 MolecularWeight: 489.6092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)C(CCC4=CC=CC=C4)O

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)C(CCC4=CC=CC=C4)O

InChI

InChI=1S/C28H35N5O3/c1-21-8-10-24(27(35)30-14-5-16-32-19-15-29-20-32)26(31-21)23-12-17-33(18-13-23)28(36)25(34)11-9-22-6-3-2-4-7-22/h2-4,6-8,10,15,19-20,23,25,34H,5,9,11-14,16-18H2,1H3,(H,30,35)