N2-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-N4-(2-propan-2-ylphenyl)quinazoline-2,4-diamine

Systemtic Name: N2-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-N4-(2-propan-2-ylphenyl)quinazoline-2,4-diamine Openeye Name: N2-[(3-bromo-4-fluoro-phenyl)methyl]-N4-(2-isopropylphenyl)quinazoline-2,4-diamine CAS Name: N2-[(3-bromo-4-fluorophenyl)methyl]-N4-(2-propan-2-ylphenyl)quinazoline-2,4-diamine IUPAC Name: 2-N-[(3-bromo-4-fluorophenyl)methyl]-4-N-(2-propan-2-ylphenyl)quinazoline-2,4-diamine Traditional Name: (3-bromo-4-fluoro-benzyl)-[4-(2-isopropylanilino)quinazolin-2-yl]amine Formula: C24H22BrFN4 MolecularWeight: 465.360683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC2=NC(=NC3=CC=CC=C32)NCC4=CC(=C(C=C4)F)Br

Isomeric SMILES

CC(C)C1=CC=CC=C1NC2=NC(=NC3=CC=CC=C32)NCC4=CC(=C(C=C4)F)Br

InChI

InChI=1S/C24H22BrFN4/c1-15(2)17-7-3-5-9-21(17)28-23-18-8-4-6-10-22(18)29-24(30-23)27-14-16-11-12-20(26)19(25)13-16/h3-13,15H,14H2,1-2H3,(H2,27,28,29,30)