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

Systemtic Name: 5-[[3-ethoxy-4-(4-methoxyphenyl)-5-phenylmethoxy-phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-benzyloxy-5-ethoxy-4-(4-methoxyphenyl)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-ethoxy-4-(4-methoxyphenyl)-5-phenylmethoxyphenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-ethoxy-4-(4-methoxyphenyl)-5-phenylmethoxyphenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-benzoxy-5-ethoxy-4-(4-methoxyphenyl)benzyl]pyrimidin-4-yl]amine Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C2=CC=C(C=C2)OC)OCC3=CC=CC=C3)CC4=CN=C(N=C4N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1C2=CC=C(C=C2)OC)OCC3=CC=CC=C3)CC4=CN=C(N=C4N)N

InChI

InChI=1S/C27H28N4O3/c1-3-33-23-14-19(13-21-16-30-27(29)31-26(21)28)15-24(34-17-18-7-5-4-6-8-18)25(23)20-9-11-22(32-2)12-10-20/h4-12,14-16H,3,13,17H2,1-2H3,(H4,28,29,30,31)