N-(2-ethanoyl-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-(2-ethanoyl-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-(2-acetyl-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl)-2-(4-pyridylmethylamino)pyridine-3-carboxamide CAS Name: N-(2-acetyl-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl)-2-(pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-(2-acetyl-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-(2-acetyl-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl)-2-(4-pyridylmethylamino)nicotinamide Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=C(C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC=NC=C4)C(C1)(C)C

Isomeric SMILES

CC(=O)N1CC2=C(C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC=NC=C4)C(C1)(C)C

InChI

InChI=1S/C25H27N5O2/c1-17(31)30-15-19-13-20(6-7-22(19)25(2,3)16-30)29-24(32)21-5-4-10-27-23(21)28-14-18-8-11-26-12-9-18/h4-13H,14-16H2,1-3H3,(H,27,28)(H,29,32)