2-[1-(1,3-benzodioxol-4-ylcarbonyl)piperidin-4-yl]-N-(4-imidazol-1-ylphenyl)-6-methyl-pyridine-3-carboxamide

Systemtic Name: 2-[1-(1,3-benzodioxol-4-ylcarbonyl)piperidin-4-yl]-N-(4-imidazol-1-ylphenyl)-6-methyl-pyridine-3-carboxamide Openeye Name: 2-[1-(1,3-benzodioxole-4-carbonyl)-4-piperidyl]-N-(4-imidazol-1-ylphenyl)-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-[1,3-benzodioxol-4-yl(oxo)methyl]-4-piperidinyl]-N-[4-(1-imidazolyl)phenyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-(1,3-benzodioxole-4-carbonyl)piperidin-4-yl]-N-(4-imidazol-1-ylphenyl)-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-(1,3-benzodioxole-4-carbonyl)-4-piperidyl]-N-(4-imidazol-1-ylphenyl)-6-methyl-nicotinamide Formula: C29H27N5O4 MolecularWeight: 509.55578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4CCN(CC4)C(=O)C5=C6C(=CC=C5)OCO6

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4CCN(CC4)C(=O)C5=C6C(=CC=C5)OCO6

InChI

InChI=1S/C29H27N5O4/c1-19-5-10-23(28(35)32-21-6-8-22(9-7-21)34-16-13-30-17-34)26(31-19)20-11-14-33(15-12-20)29(36)24-3-2-4-25-27(24)38-18-37-25/h2-10,13,16-17,20H,11-12,14-15,18H2,1H3,(H,32,35)