5-[[3-methoxy-4-(3-phenylpropoxy)phenyl]methoxy]pyrimidine-2,4-diamine

Systemtic Name: 5-[[3-methoxy-4-(3-phenylpropoxy)phenyl]methoxy]pyrimidine-2,4-diamine Openeye Name: 5-[[3-methoxy-4-(3-phenylpropoxy)phenyl]methoxy]pyrimidine-2,4-diamine CAS Name: 5-[[3-methoxy-4-(3-phenylpropoxy)phenyl]methoxy]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-methoxy-4-(3-phenylpropoxy)phenyl]methoxy]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-methoxy-4-(3-phenylpropoxy)benzyl]oxy-pyrimidin-4-yl]amine Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)COC2=CN=C(N=C2N)N)OCCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)COC2=CN=C(N=C2N)N)OCCCC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3/c1-26-18-12-16(14-28-19-13-24-21(23)25-20(19)22)9-10-17(18)27-11-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-10,12-13H,5,8,11,14H2,1H3,(H4,22,23,24,25)