N-[4,4-dimethyl-2-[(2R)-oxolan-2-yl]carbonyl-1,3-dihydroisoquinolin-7-yl]-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide

Systemtic Name: N-[4,4-dimethyl-2-[(2R)-oxolan-2-yl]carbonyl-1,3-dihydroisoquinolin-7-yl]-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide Openeye Name: N-[4,4-dimethyl-2-[(2R)-tetrahydrofuran-2-carbonyl]-1,3-dihydroisoquinolin-7-yl]-2-(7-isoquinolylamino)pyridine-3-carboxamide CAS Name: N-[4,4-dimethyl-2-[oxo-[(2R)-2-oxolanyl]methyl]-1,3-dihydroisoquinolin-7-yl]-2-(7-isoquinolinylamino)-3-pyridinecarboxamide IUPAC Name: N-[4,4-dimethyl-2-[(2R)-oxolane-2-carbonyl]-1,3-dihydroisoquinolin-7-yl]-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide Traditional Name: N-[4,4-dimethyl-2-[(2R)-tetrahydrofuran-2-carbonyl]-1,3-dihydroisoquinolin-7-yl]-2-(7-isoquinolylamino)nicotinamide Formula: C31H31N5O3 MolecularWeight: 521.60954

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NC4=CC5=C(C=C4)C=CN=C5)C(=O)C6CCCO6)C

Isomeric SMILES

CC1(CN(CC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NC4=CC5=C(C=C4)C=CN=C5)C(=O)[C@H]6CCCO6)C

InChI

InChI=1S/C31H31N5O3/c1-31(2)19-36(30(38)27-6-4-14-39-27)18-22-16-24(9-10-26(22)31)35-29(37)25-5-3-12-33-28(25)34-23-8-7-20-11-13-32-17-21(20)15-23/h3,5,7-13,15-17,27H,4,6,14,18-19H2,1-2H3,(H,33,34)(H,35,37)/t27-/m1/s1