2-cyclohexyl-9-(2,3-dimethoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-cyclohexyl-9-(2,3-dimethoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-cyclohexyl-9-(2,3-dimethoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-cyclohexyl-9-(2,3-dimethoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-cyclohexyl-9-(2,3-dimethoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-cyclohexyl-9-(2,3-dimethoxyphenyl)-8-keto-7H-purine-6-carboxamide Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1OC)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4CCCCC4

InChI

InChI=1S/C20H23N5O4/c1-28-13-10-6-9-12(16(13)29-2)25-19-15(23-20(25)27)14(17(21)26)22-18(24-19)11-7-4-3-5-8-11/h6,9-11H,3-5,7-8H2,1-2H3,(H2,21,26)(H,23,27)