N-(4-tert-butylphenyl)-4-quinazolin-6-yl-isoquinolin-1-amine

Systemtic Name: N-(4-tert-butylphenyl)-4-quinazolin-6-yl-isoquinolin-1-amine Openeye Name: N-(4-tert-butylphenyl)-4-quinazolin-6-yl-isoquinolin-1-amine CAS Name: N-(4-tert-butylphenyl)-4-(6-quinazolinyl)-1-isoquinolinamine IUPAC Name: N-(4-tert-butylphenyl)-4-quinazolin-6-ylisoquinolin-1-amine Traditional Name: (4-tert-butylphenyl)-(4-quinazolin-6-yl-1-isoquinolyl)amine Formula: C27H24N4 MolecularWeight: 404.50626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2=NC=C(C3=CC=CC=C32)C4=CC5=CN=CN=C5C=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=NC=C(C3=CC=CC=C32)C4=CC5=CN=CN=C5C=C4

InChI

InChI=1S/C27H24N4/c1-27(2,3)20-9-11-21(12-10-20)31-26-23-7-5-4-6-22(23)24(16-29-26)18-8-13-25-19(14-18)15-28-17-30-25/h4-17H,1-3H3,(H,29,31)