6-[2,4-bis(chloranyl)-6-methyl-phenyl]-9-(1-cyclopropylprop-2-enyl)-8-ethyl-purine

Systemtic Name: 6-[2,4-bis(chloranyl)-6-methyl-phenyl]-9-(1-cyclopropylprop-2-enyl)-8-ethyl-purine Openeye Name: 9-(1-cyclopropylallyl)-6-(2,4-dichloro-6-methyl-phenyl)-8-ethyl-purine CAS Name: 9-(1-cyclopropylprop-2-enyl)-6-(2,4-dichloro-6-methylphenyl)-8-ethylpurine IUPAC Name: 9-(1-cyclopropylprop-2-enyl)-6-(2,4-dichloro-6-methylphenyl)-8-ethylpurine Traditional Name: 9-(1-cyclopropylallyl)-6-(2,4-dichloro-6-methyl-phenyl)-8-ethyl-purine Formula: C20H20Cl2N4 MolecularWeight: 387.3056

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N=CN=C2N1C(C=C)C3CC3)C4=C(C=C(C=C4C)Cl)Cl

Isomeric SMILES

CCC1=NC2=C(N=CN=C2N1C(C=C)C3CC3)C4=C(C=C(C=C4C)Cl)Cl

InChI

InChI=1S/C20H20Cl2N4/c1-4-15(12-6-7-12)26-16(5-2)25-19-18(23-10-24-20(19)26)17-11(3)8-13(21)9-14(17)22/h4,8-10,12,15H,1,5-7H2,2-3H3