5-[[3-ethoxy-4-(4-methoxyphenyl)-5-(2-methylpropoxy)phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[3-ethoxy-4-(4-methoxyphenyl)-5-(2-methylpropoxy)phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-ethoxy-5-isobutoxy-4-(4-methoxyphenyl)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-ethoxy-4-(4-methoxyphenyl)-5-(2-methylpropoxy)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-ethoxy-4-(4-methoxyphenyl)-5-(2-methylpropoxy)phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-ethoxy-5-isobutoxy-4-(4-methoxyphenyl)benzyl]pyrimidin-4-yl]amine Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)OCC(C)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)OCC(C)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H30N4O3/c1-5-30-20-11-16(10-18-13-27-24(26)28-23(18)25)12-21(31-14-15(2)3)22(20)17-6-8-19(29-4)9-7-17/h6-9,11-13,15H,5,10,14H2,1-4H3,(H4,25,26,27,28)