N-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-2-(quinolin-7-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-2-(quinolin-7-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-2-(7-quinolylmethylamino)pyridine-3-carboxamide CAS Name: N-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-2-(7-quinolinylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-2-(quinolin-7-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-2-(7-quinolylmethylamino)nicotinamide Formula: C27H27N5O MolecularWeight: 437.53618

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CNCC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC5=C(C=CC=N5)C=C4)C

Isomeric SMILES

CC1(CNCC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC5=C(C=CC=N5)C=C4)C

InChI

InChI=1S/C27H27N5O/c1-27(2)17-28-16-20-14-21(9-10-23(20)27)32-26(33)22-6-4-12-30-25(22)31-15-18-7-8-19-5-3-11-29-24(19)13-18/h3-14,28H,15-17H2,1-2H3,(H,30,31)(H,32,33)