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

Systemtic Name: 5-[[3-(3-methoxypropoxy)-5-phenyl-phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-(3-methoxypropoxy)-5-phenyl-phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-(3-methoxypropoxy)-5-phenylphenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-(3-methoxypropoxy)-5-phenylphenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-(3-methoxypropoxy)-5-phenyl-benzyl]pyrimidin-4-yl]amine Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

COCCCOC1=CC(=CC(=C1)CC2=CN=C(N=C2N)N)C3=CC=CC=C3

Isomeric SMILES

COCCCOC1=CC(=CC(=C1)CC2=CN=C(N=C2N)N)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O2/c1-26-8-5-9-27-19-12-15(11-18-14-24-21(23)25-20(18)22)10-17(13-19)16-6-3-2-4-7-16/h2-4,6-7,10,12-14H,5,8-9,11H2,1H3,(H4,22,23,24,25)