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

Systemtic Name: 5-[[3-methoxy-4-(2-phenoxyethoxy)phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-methoxy-4-(2-phenoxyethoxy)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-methoxy-4-(2-phenoxyethoxy)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-methoxy-4-(2-phenoxyethoxy)phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-methoxy-4-(2-phenoxyethoxy)benzyl]pyrimidin-4-yl]amine Formula: C20H22N4O3 MolecularWeight: 366.41368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC2=CN=C(N=C2N)N)OCCOC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=CN=C(N=C2N)N)OCCOC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3/c1-25-18-12-14(11-15-13-23-20(22)24-19(15)21)7-8-17(18)27-10-9-26-16-5-3-2-4-6-16/h2-8,12-13H,9-11H2,1H3,(H4,21,22,23,24)