2-(1-isoquinolin-3-ylcarbonylpiperidin-4-yl)-6-methyl-N-(2-propoxyethyl)pyridine-3-carboxamide

Systemtic Name: 2-(1-isoquinolin-3-ylcarbonylpiperidin-4-yl)-6-methyl-N-(2-propoxyethyl)pyridine-3-carboxamide Openeye Name: 2-[1-(isoquinoline-3-carbonyl)-4-piperidyl]-6-methyl-N-(2-propoxyethyl)pyridine-3-carboxamide CAS Name: 2-[1-[3-isoquinolinyl(oxo)methyl]-4-piperidinyl]-6-methyl-N-(2-propoxyethyl)-3-pyridinecarboxamide IUPAC Name: 2-[1-(isoquinoline-3-carbonyl)piperidin-4-yl]-6-methyl-N-(2-propoxyethyl)pyridine-3-carboxamide Traditional Name: 2-[1-(isoquinoline-3-carbonyl)-4-piperidyl]-6-methyl-N-(2-propoxyethyl)nicotinamide Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCNC(=O)C1=C(N=C(C=C1)C)C2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=N3

Isomeric SMILES

CCCOCCNC(=O)C1=C(N=C(C=C1)C)C2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=N3

InChI

InChI=1S/C27H32N4O3/c1-3-15-34-16-12-28-26(32)23-9-8-19(2)30-25(23)20-10-13-31(14-11-20)27(33)24-17-21-6-4-5-7-22(21)18-29-24/h4-9,17-18,20H,3,10-16H2,1-2H3,(H,28,32)