5-(4-propoxyphenyl)pyrimidine-2,4-diamine

Systemtic Name: 5-(4-propoxyphenyl)pyrimidine-2,4-diamine Openeye Name: 5-(4-propoxyphenyl)pyrimidine-2,4-diamine CAS Name: 5-(4-propoxyphenyl)pyrimidine-2,4-diamine IUPAC Name: 5-(4-propoxyphenyl)pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4-propoxyphenyl)pyrimidin-4-yl]amine Formula: C13H16N4O MolecularWeight: 244.29234

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CN=C(N=C2N)N

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CN=C(N=C2N)N

InChI

InChI=1S/C13H16N4O/c1-2-7-18-10-5-3-9(4-6-10)11-8-16-13(15)17-12(11)14/h3-6,8H,2,7H2,1H3,(H4,14,15,16,17)