N2-(3,4-diethoxyphenyl)-N4-quinolin-3-yl-pyrimidine-2,4-diamine

Systemtic Name: N2-(3,4-diethoxyphenyl)-N4-quinolin-3-yl-pyrimidine-2,4-diamine Openeye Name: N2-(3,4-diethoxyphenyl)-N4-(3-quinolyl)pyrimidine-2,4-diamine CAS Name: N2-(3,4-diethoxyphenyl)-N4-(3-quinolinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-(3,4-diethoxyphenyl)-4-N-quinolin-3-ylpyrimidine-2,4-diamine Traditional Name: [2-(3,4-diethoxyanilino)pyrimidin-4-yl]-(3-quinolyl)amine Formula: C23H23N5O2 MolecularWeight: 401.46102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC2=NC=CC(=N2)NC3=CC4=CC=CC=C4N=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC2=NC=CC(=N2)NC3=CC4=CC=CC=C4N=C3)OCC

InChI

InChI=1S/C23H23N5O2/c1-3-29-20-10-9-17(14-21(20)30-4-2)27-23-24-12-11-22(28-23)26-18-13-16-7-5-6-8-19(16)25-15-18/h5-15H,3-4H2,1-2H3,(H2,24,26,27,28)