3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(2-methylpentan-3-yl)-2H-purin-6-one

Systemtic Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(2-methylpentan-3-yl)-2H-purin-6-one Openeye Name: 3-(2,4-dichlorophenyl)-8-ethyl-7-(1-ethyl-2-methyl-propyl)-1-methyl-2H-purin-6-one CAS Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(2-methylpentan-3-yl)-2H-purin-6-one IUPAC Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(2-methylpentan-3-yl)-2H-purin-6-one Traditional Name: 3-(2,4-dichlorophenyl)-8-ethyl-7-(1-ethyl-2-methyl-propyl)-1-methyl-2H-purin-6-one Formula: C20H26Cl2N4O MolecularWeight: 409.35264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C(CC)C(C)C)C(=O)N(CN2C3=C(C=C(C=C3)Cl)Cl)C

Isomeric SMILES

CCC1=NC2=C(N1C(CC)C(C)C)C(=O)N(CN2C3=C(C=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C20H26Cl2N4O/c1-6-15(12(3)4)26-17(7-2)23-19-18(26)20(27)24(5)11-25(19)16-9-8-13(21)10-14(16)22/h8-10,12,15H,6-7,11H2,1-5H3