5-[[3,4-bis(phenylmethoxy)phenyl]methyl]-6-ethyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[[3,4-bis(phenylmethoxy)phenyl]methyl]-6-ethyl-pyrimidine-2,4-diamine Openeye Name: 5-[(3,4-dibenzyloxyphenyl)methyl]-6-ethyl-pyrimidine-2,4-diamine CAS Name: 5-[[3,4-bis(phenylmethoxy)phenyl]methyl]-6-ethylpyrimidine-2,4-diamine IUPAC Name: 5-[[3,4-bis(phenylmethoxy)phenyl]methyl]-6-ethylpyrimidine-2,4-diamine Traditional Name: [2-amino-5-(3,4-dibenzoxybenzyl)-6-ethyl-pyrimidin-4-yl]amine Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H28N4O2/c1-2-23-22(26(28)31-27(29)30-23)15-21-13-14-24(32-17-19-9-5-3-6-10-19)25(16-21)33-18-20-11-7-4-8-12-20/h3-14,16H,2,15,17-18H2,1H3,(H4,28,29,30,31)