5-[[3,5-diethoxy-4-(4-methoxy-3-methyl-phenyl)phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[3,5-diethoxy-4-(4-methoxy-3-methyl-phenyl)phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3,5-diethoxy-4-(4-methoxy-3-methyl-phenyl)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3,5-diethoxy-4-(4-methoxy-3-methylphenyl)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3,5-diethoxy-4-(4-methoxy-3-methylphenyl)phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3,5-diethoxy-4-(4-methoxy-3-methyl-phenyl)benzyl]pyrimidin-4-yl]amine Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C2=CC(=C(C=C2)OC)C)OCC)CC3=CN=C(N=C3N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1C2=CC(=C(C=C2)OC)C)OCC)CC3=CN=C(N=C3N)N

InChI

InChI=1S/C23H28N4O3/c1-5-29-19-11-15(10-17-13-26-23(25)27-22(17)24)12-20(30-6-2)21(19)16-7-8-18(28-4)14(3)9-16/h7-9,11-13H,5-6,10H2,1-4H3,(H4,24,25,26,27)