9-[[2,6-bis(bromanyl)-3,5-dimethoxy-phenyl]methyl]-6-chloranyl-purin-2-amine

Systemtic Name: 9-[[2,6-bis(bromanyl)-3,5-dimethoxy-phenyl]methyl]-6-chloranyl-purin-2-amine Openeye Name: 6-chloro-9-[(2,6-dibromo-3,5-dimethoxy-phenyl)methyl]purin-2-amine CAS Name: 6-chloro-9-[(2,6-dibromo-3,5-dimethoxyphenyl)methyl]-2-purinamine IUPAC Name: 6-chloro-9-[(2,6-dibromo-3,5-dimethoxyphenyl)methyl]purin-2-amine Traditional Name: [6-chloro-9-(2,6-dibromo-3,5-dimethoxy-benzyl)purin-2-yl]amine Formula: C14H12Br2ClN5O2 MolecularWeight: 477.53838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1Br)CN2C=NC3=C2N=C(N=C3Cl)N)Br)OC

Isomeric SMILES

COC1=CC(=C(C(=C1Br)CN2C=NC3=C2N=C(N=C3Cl)N)Br)OC

InChI

InChI=1S/C14H12Br2ClN5O2/c1-23-7-3-8(24-2)10(16)6(9(7)15)4-22-5-19-11-12(17)20-14(18)21-13(11)22/h3,5H,4H2,1-2H3,(H2,18,20,21)