5-[(3,5-diethoxy-4-quinolin-6-yl-phenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(3,5-diethoxy-4-quinolin-6-yl-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3,5-diethoxy-4-(6-quinolyl)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3,5-diethoxy-4-(6-quinolinyl)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(3,5-diethoxy-4-quinolin-6-ylphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3,5-diethoxy-4-(6-quinolyl)benzyl]pyrimidin-4-yl]amine Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C2=CC3=C(C=C2)N=CC=C3)OCC)CC4=CN=C(N=C4N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1C2=CC3=C(C=C2)N=CC=C3)OCC)CC4=CN=C(N=C4N)N

InChI

InChI=1S/C24H25N5O2/c1-3-30-20-11-15(10-18-14-28-24(26)29-23(18)25)12-21(31-4-2)22(20)17-7-8-19-16(13-17)6-5-9-27-19/h5-9,11-14H,3-4,10H2,1-2H3,(H4,25,26,28,29)