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

Systemtic Name: 5-[(3-bromanyl-4-methoxy-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(3-bromo-4-methoxy-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(3-bromo-4-methoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(3-bromo-4-methoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(3-bromo-4-methoxy-benzyl)pyrimidin-4-yl]amine Formula: C12H13BrN4O MolecularWeight: 309.16182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)Br

InChI

InChI=1S/C12H13BrN4O/c1-18-10-3-2-7(5-9(10)13)4-8-6-16-12(15)17-11(8)14/h2-3,5-6H,4H2,1H3,(H4,14,15,16,17)