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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2=NC=C(C3=CC=CC=C32)C4=NC=NC5=CC=CC=C54

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=NC=C(C3=CC=CC=C32)C4=NC=NC5=CC=CC=C54

InChI

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