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

Systemtic Name: 3-(2,4-dimethylphenyl)-8-ethyl-7-heptan-4-yl-1-methyl-2H-purin-6-one Openeye Name: 3-(2,4-dimethylphenyl)-8-ethyl-1-methyl-7-(1-propylbutyl)-2H-purin-6-one CAS Name: 3-(2,4-dimethylphenyl)-8-ethyl-7-heptan-4-yl-1-methyl-2H-purin-6-one IUPAC Name: 3-(2,4-dimethylphenyl)-8-ethyl-7-heptan-4-yl-1-methyl-2H-purin-6-one Traditional Name: 3-(2,4-dimethylphenyl)-8-ethyl-1-methyl-7-(1-propylbutyl)-2H-purin-6-one Formula: C23H34N4O MolecularWeight: 382.54226

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C(=NC2=C1C(=O)N(CN2C3=C(C=C(C=C3)C)C)C)CC

Isomeric SMILES

CCCC(CCC)N1C(=NC2=C1C(=O)N(CN2C3=C(C=C(C=C3)C)C)C)CC

InChI

InChI=1S/C23H34N4O/c1-7-10-18(11-8-2)27-20(9-3)24-22-21(27)23(28)25(6)15-26(22)19-13-12-16(4)14-17(19)5/h12-14,18H,7-11,15H2,1-6H3