9-(1-cyclopropylbut-2-ynyl)-6-(2,4-dichlorophenyl)-8-ethyl-purine

Systemtic Name: 9-(1-cyclopropylbut-2-ynyl)-6-(2,4-dichlorophenyl)-8-ethyl-purine Openeye Name: 9-(1-cyclopropylbut-2-ynyl)-6-(2,4-dichlorophenyl)-8-ethyl-purine CAS Name: 9-(1-cyclopropylbut-2-ynyl)-6-(2,4-dichlorophenyl)-8-ethylpurine IUPAC Name: 9-(1-cyclopropylbut-2-ynyl)-6-(2,4-dichlorophenyl)-8-ethylpurine Traditional Name: 9-(1-cyclopropylbut-2-ynyl)-6-(2,4-dichlorophenyl)-8-ethyl-purine Formula: C20H18Cl2N4 MolecularWeight: 385.28972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18Cl2N4/c1-3-5-16(12-6-7-12)26-17(4-2)25-19-18(23-11-24-20(19)26)14-9-8-13(21)10-15(14)22/h8-12,16H,4,6-7H2,1-2H3