5-[[2,6-bis(bromanyl)-3,4,5-trimethoxy-phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[2,6-bis(bromanyl)-3,4,5-trimethoxy-phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(2,6-dibromo-3,4,5-trimethoxy-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(2,6-dibromo-3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(2,6-dibromo-3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(2,6-dibromo-3,4,5-trimethoxy-benzyl)pyrimidin-4-yl]amine Formula: C14H16Br2N4O3 MolecularWeight: 448.10984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1OC)Br)CC2=CN=C(N=C2N)N)Br)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1OC)Br)CC2=CN=C(N=C2N)N)Br)OC

InChI

InChI=1S/C14H16Br2N4O3/c1-21-10-8(15)7(9(16)11(22-2)12(10)23-3)4-6-5-19-14(18)20-13(6)17/h5H,4H2,1-3H3,(H4,17,18,19,20)