6-(3,5-dimethylphenoxy)-N4-pyridin-4-yl-pyrimidine-4,5-diamine

Systemtic Name: 6-(3,5-dimethylphenoxy)-N4-pyridin-4-yl-pyrimidine-4,5-diamine Openeye Name: 6-(3,5-dimethylphenoxy)-N4-(4-pyridyl)pyrimidine-4,5-diamine CAS Name: 6-(3,5-dimethylphenoxy)-N4-pyridin-4-ylpyrimidine-4,5-diamine IUPAC Name: 6-(3,5-dimethylphenoxy)-4-N-pyridin-4-ylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]-(4-pyridyl)amine Formula: C17H17N5O MolecularWeight: 307.34978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)NC3=CC=NC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)NC3=CC=NC=C3)C

InChI

InChI=1S/C17H17N5O/c1-11-7-12(2)9-14(8-11)23-17-15(18)16(20-10-21-17)22-13-3-5-19-6-4-13/h3-10H,18H2,1-2H3,(H,19,20,21,22)