2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one

Systemtic Name: 2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one Openeye Name: 2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(4-pyridylmethylamino)isoindolin-1-one CAS Name: 2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one IUPAC Name: 2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one Traditional Name: 2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(4-pyridylmethylamino)isoindolin-1-one Formula: C25H26N4O MolecularWeight: 398.50014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CNCC2=C1C=CC(=C2)N3CC4=C(C3=O)C(=CC=C4)NCC5=CC=NC=C5)C

Isomeric SMILES

CC1(CNCC2=C1C=CC(=C2)N3CC4=C(C3=O)C(=CC=C4)NCC5=CC=NC=C5)C

InChI

InChI=1S/C25H26N4O/c1-25(2)16-27-14-19-12-20(6-7-21(19)25)29-15-18-4-3-5-22(23(18)24(29)30)28-13-17-8-10-26-11-9-17/h3-12,27-28H,13-16H2,1-2H3