6-(2-chloranyl-4-methyl-phenyl)-8-ethyl-9-pentyl-purine

Systemtic Name: 6-(2-chloranyl-4-methyl-phenyl)-8-ethyl-9-pentyl-purine Openeye Name: 6-(2-chloro-4-methyl-phenyl)-8-ethyl-9-pentyl-purine CAS Name: 6-(2-chloro-4-methylphenyl)-8-ethyl-9-pentylpurine IUPAC Name: 6-(2-chloro-4-methylphenyl)-8-ethyl-9-pentylpurine Traditional Name: 9-amyl-6-(2-chloro-4-methyl-phenyl)-8-ethyl-purine Formula: C19H23ClN4 MolecularWeight: 342.86572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C(N=CN=C21)C3=C(C=C(C=C3)C)Cl)CC

Isomeric SMILES

CCCCCN1C(=NC2=C(N=CN=C21)C3=C(C=C(C=C3)C)Cl)CC

InChI

InChI=1S/C19H23ClN4/c1-4-6-7-10-24-16(5-2)23-18-17(21-12-22-19(18)24)14-9-8-13(3)11-15(14)20/h8-9,11-12H,4-7,10H2,1-3H3