6-(2,4-dichlorophenyl)-8-ethyl-9-hex-4-yn-3-yl-purine

Systemtic Name: 6-(2,4-dichlorophenyl)-8-ethyl-9-hex-4-yn-3-yl-purine Openeye Name: 6-(2,4-dichlorophenyl)-8-ethyl-9-(1-ethylbut-2-ynyl)purine CAS Name: 6-(2,4-dichlorophenyl)-8-ethyl-9-hex-4-yn-3-ylpurine IUPAC Name: 6-(2,4-dichlorophenyl)-8-ethyl-9-hex-4-yn-3-ylpurine Traditional Name: 6-(2,4-dichlorophenyl)-8-ethyl-9-(1-ethylbut-2-ynyl)purine Formula: C19H18Cl2N4 MolecularWeight: 373.27902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N=CN=C2N1C(CC)C#CC)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCC1=NC2=C(N=CN=C2N1C(CC)C#CC)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H18Cl2N4/c1-4-7-13(5-2)25-16(6-3)24-18-17(22-11-23-19(18)25)14-9-8-12(20)10-15(14)21/h8-11,13H,5-6H2,1-3H3