2,8-dimethyl-9-[2,4,6-tris(chloranyl)phenyl]purin-6-amine

Systemtic Name: 2,8-dimethyl-9-[2,4,6-tris(chloranyl)phenyl]purin-6-amine Openeye Name: 2,8-dimethyl-9-(2,4,6-trichlorophenyl)purin-6-amine CAS Name: 2,8-dimethyl-9-(2,4,6-trichlorophenyl)-6-purinamine IUPAC Name: 2,8-dimethyl-9-(2,4,6-trichlorophenyl)purin-6-amine Traditional Name: [2,8-dimethyl-9-(2,4,6-trichlorophenyl)purin-6-yl]amine Formula: C13H10Cl3N5 MolecularWeight: 342.611

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N)N=C(N2C3=C(C=C(C=C3Cl)Cl)Cl)C

Isomeric SMILES

CC1=NC2=C(C(=N1)N)N=C(N2C3=C(C=C(C=C3Cl)Cl)Cl)C

InChI

InChI=1S/C13H10Cl3N5/c1-5-18-12(17)10-13(19-5)21(6(2)20-10)11-8(15)3-7(14)4-9(11)16/h3-4H,1-2H3,(H2,17,18,19)