N-(4-tert-butylphenyl)-4-quinolin-5-yl-phthalazin-1-amine

Systemtic Name: N-(4-tert-butylphenyl)-4-quinolin-5-yl-phthalazin-1-amine Openeye Name: N-(4-tert-butylphenyl)-4-(5-quinolyl)phthalazin-1-amine CAS Name: N-(4-tert-butylphenyl)-4-(5-quinolinyl)-1-phthalazinamine IUPAC Name: N-(4-tert-butylphenyl)-4-quinolin-5-ylphthalazin-1-amine Traditional Name: (4-tert-butylphenyl)-[4-(5-quinolyl)phthalazin-1-yl]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=NN=C(C3=CC=CC=C32)C4=C5C=CC=NC5=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=C5C=CC=NC5=CC=C4

InChI

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