9-cyclohexyl-2-(2,5-dimethoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-cyclohexyl-2-(2,5-dimethoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-cyclohexyl-2-(2,5-dimethoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-cyclohexyl-2-(2,5-dimethoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-cyclohexyl-2-(2,5-dimethoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-cyclohexyl-2-(2,5-dimethoxyphenyl)-8-keto-7H-purine-6-carboxamide Formula: C20H23N5O4 MolecularWeight: 397.42772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NC(=C3C(=N2)N(C(=O)N3)C4CCCCC4)C(=O)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NC(=C3C(=N2)N(C(=O)N3)C4CCCCC4)C(=O)N

InChI

InChI=1S/C20H23N5O4/c1-28-12-8-9-14(29-2)13(10-12)18-22-15(17(21)26)16-19(24-18)25(20(27)23-16)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H2,21,26)(H,23,27)