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

Systemtic Name: 5-[[3-ethoxy-4-[4-(methylamino)phenyl]-5-phenylmethoxy-phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-benzyloxy-5-ethoxy-4-[4-(methylamino)phenyl]phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-ethoxy-4-[4-(methylamino)phenyl]-5-phenylmethoxyphenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-ethoxy-4-[4-(methylamino)phenyl]-5-phenylmethoxyphenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [4-[2-benzoxy-4-[(2,4-diaminopyrimidin-5-yl)methyl]-6-ethoxy-phenyl]phenyl]-methyl-amine Formula: C27H29N5O2 MolecularWeight: 455.55146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N5O2/c1-3-33-23-14-19(13-21-16-31-27(29)32-26(21)28)15-24(34-17-18-7-5-4-6-8-18)25(23)20-9-11-22(30-2)12-10-20/h4-12,14-16,30H,3,13,17H2,1-2H3,(H4,28,29,31,32)