5-[(2-iodanyl-3,4,5-trimethoxy-phenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(2-iodanyl-3,4,5-trimethoxy-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(2-iodo-3,4,5-trimethoxy-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(2-iodo-3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(2-iodo-3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(2-iodo-3,4,5-trimethoxy-benzyl)pyrimidin-4-yl]amine Formula: C14H17IN4O3 MolecularWeight: 416.21425

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)CC2=CN=C(N=C2N)N)I)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)CC2=CN=C(N=C2N)N)I)OC)OC

InChI

InChI=1S/C14H17IN4O3/c1-20-9-5-7(10(15)12(22-3)11(9)21-2)4-8-6-18-14(17)19-13(8)16/h5-6H,4H2,1-3H3,(H4,16,17,18,19)