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

Systemtic Name: 3-(2,4-dimethylpyridin-3-yl)-8-ethyl-7-heptan-4-yl-1-methyl-2H-purin-6-one Openeye Name: 3-(2,4-dimethyl-3-pyridyl)-8-ethyl-1-methyl-7-(1-propylbutyl)-2H-purin-6-one CAS Name: 3-(2,4-dimethyl-3-pyridinyl)-8-ethyl-7-heptan-4-yl-1-methyl-2H-purin-6-one IUPAC Name: 3-(2,4-dimethylpyridin-3-yl)-8-ethyl-7-heptan-4-yl-1-methyl-2H-purin-6-one Traditional Name: 3-(2,4-dimethyl-3-pyridyl)-8-ethyl-1-methyl-7-(1-propylbutyl)-2H-purin-6-one Formula: C22H33N5O MolecularWeight: 383.53032

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C(=NC2=C1C(=O)N(CN2C3=C(C=CN=C3C)C)C)CC

Isomeric SMILES

CCCC(CCC)N1C(=NC2=C1C(=O)N(CN2C3=C(C=CN=C3C)C)C)CC

InChI

InChI=1S/C22H33N5O/c1-7-10-17(11-8-2)27-18(9-3)24-21-20(27)22(28)25(6)14-26(21)19-15(4)12-13-23-16(19)5/h12-13,17H,7-11,14H2,1-6H3