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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=NC2=C1C(=O)N(CN2C3=C(C=CN=C3C)C)C)CC

Isomeric SMILES

CCCCCCCN1C(=NC2=C1C(=O)N(CN2C3=C(C=CN=C3C)C)C)CC

InChI

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