N4-(3,5-dimethylphenyl)-6-quinolin-8-yloxy-pyrimidine-4,5-diamine

Systemtic Name: N4-(3,5-dimethylphenyl)-6-quinolin-8-yloxy-pyrimidine-4,5-diamine Openeye Name: N4-(3,5-dimethylphenyl)-6-(8-quinolyloxy)pyrimidine-4,5-diamine CAS Name: N4-(3,5-dimethylphenyl)-6-(8-quinolinyloxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(3,5-dimethylphenyl)-6-quinolin-8-yloxypyrimidine-4,5-diamine Traditional Name: [5-amino-6-(8-quinolyloxy)pyrimidin-4-yl]-(3,5-dimethylphenyl)amine Formula: C21H19N5O MolecularWeight: 357.40846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)OC3=CC=CC4=C3N=CC=C4)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)OC3=CC=CC4=C3N=CC=C4)N)C

InChI

InChI=1S/C21H19N5O/c1-13-9-14(2)11-16(10-13)26-20-18(22)21(25-12-24-20)27-17-7-3-5-15-6-4-8-23-19(15)17/h3-12H,22H2,1-2H3,(H,24,25,26)