N4-(3-bromophenyl)-N6-[(2,5-dimethylphenyl)methyl]quinazoline-4,6-diamine

Systemtic Name: N4-(3-bromophenyl)-N6-[(2,5-dimethylphenyl)methyl]quinazoline-4,6-diamine Openeye Name: N4-(3-bromophenyl)-N6-[(2,5-dimethylphenyl)methyl]quinazoline-4,6-diamine CAS Name: N4-(3-bromophenyl)-N6-[(2,5-dimethylphenyl)methyl]quinazoline-4,6-diamine IUPAC Name: 4-N-(3-bromophenyl)-6-N-[(2,5-dimethylphenyl)methyl]quinazoline-4,6-diamine Traditional Name: [4-(3-bromoanilino)quinazolin-6-yl]-(2,5-dimethylbenzyl)amine Formula: C23H21BrN4 MolecularWeight: 433.34364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CNC2=CC3=C(C=C2)N=CN=C3NC4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)CNC2=CC3=C(C=C2)N=CN=C3NC4=CC(=CC=C4)Br

InChI

InChI=1S/C23H21BrN4/c1-15-6-7-16(2)17(10-15)13-25-19-8-9-22-21(12-19)23(27-14-26-22)28-20-5-3-4-18(24)11-20/h3-12,14,25H,13H2,1-2H3,(H,26,27,28)