5-[[3,5-diethoxy-4-(2-morpholin-4-ylpyrimidin-5-yl)phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[3,5-diethoxy-4-(2-morpholin-4-ylpyrimidin-5-yl)phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3,5-diethoxy-4-(2-morpholinopyrimidin-5-yl)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3,5-diethoxy-4-[2-(4-morpholinyl)-5-pyrimidinyl]phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3,5-diethoxy-4-(2-morpholin-4-ylpyrimidin-5-yl)phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3,5-diethoxy-4-(2-morpholinopyrimidin-5-yl)benzyl]pyrimidin-4-yl]amine Formula: C23H29N7O3 MolecularWeight: 451.52146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C2=CN=C(N=C2)N3CCOCC3)OCC)CC4=CN=C(N=C4N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1C2=CN=C(N=C2)N3CCOCC3)OCC)CC4=CN=C(N=C4N)N

InChI

InChI=1S/C23H29N7O3/c1-3-32-18-10-15(9-16-12-26-22(25)29-21(16)24)11-19(33-4-2)20(18)17-13-27-23(28-14-17)30-5-7-31-8-6-30/h10-14H,3-9H2,1-2H3,(H4,24,25,26,29)