6-[1-[(3,3-dimethyl-1,2-dihydroindol-6-yl)amino]-6-methyl-isoquinolin-5-yl]-N-methyl-quinazolin-2-amine

Systemtic Name: 6-[1-[(3,3-dimethyl-1,2-dihydroindol-6-yl)amino]-6-methyl-isoquinolin-5-yl]-N-methyl-quinazolin-2-amine Openeye Name: 6-[1-[(3,3-dimethylindolin-6-yl)amino]-6-methyl-5-isoquinolyl]-N-methyl-quinazolin-2-amine CAS Name: 6-[1-[(3,3-dimethyl-1,2-dihydroindol-6-yl)amino]-6-methyl-5-isoquinolinyl]-N-methyl-2-quinazolinamine IUPAC Name: 6-[1-[(3,3-dimethyl-1,2-dihydroindol-6-yl)amino]-6-methylisoquinolin-5-yl]-N-methylquinazolin-2-amine Traditional Name: (3,3-dimethylindolin-6-yl)-[6-methyl-5-[2-(methylamino)quinazolin-6-yl]-1-isoquinolyl]amine Formula: C29H28N6 MolecularWeight: 460.57282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=NC=C2)NC3=CC4=C(C=C3)C(CN4)(C)C)C5=CC6=CN=C(N=C6C=C5)NC

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=NC=C2)NC3=CC4=C(C=C3)C(CN4)(C)C)C5=CC6=CN=C(N=C6C=C5)NC

InChI

InChI=1S/C29H28N6/c1-17-5-8-22-21(26(17)18-6-10-24-19(13-18)15-32-28(30-4)35-24)11-12-31-27(22)34-20-7-9-23-25(14-20)33-16-29(23,2)3/h5-15,33H,16H2,1-4H3,(H,31,34)(H,30,32,35)