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

Systemtic Name: 5-[[3-ethoxy-4-(3-phenoxypropoxy)phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-ethoxy-4-(3-phenoxypropoxy)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-ethoxy-4-(3-phenoxypropoxy)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-ethoxy-4-(3-phenoxypropoxy)phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-ethoxy-4-(3-phenoxypropoxy)benzyl]pyrimidin-4-yl]amine Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CC2=CN=C(N=C2N)N)OCCCOC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)CC2=CN=C(N=C2N)N)OCCCOC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O3/c1-2-27-20-14-16(13-17-15-25-22(24)26-21(17)23)9-10-19(20)29-12-6-11-28-18-7-4-3-5-8-18/h3-5,7-10,14-15H,2,6,11-13H2,1H3,(H4,23,24,25,26)