(2E)-9-cyclohexyl-2-(5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-8-oxidanylidene-1,7-dihydropurine-6-carboxamide

Systemtic Name: (2E)-9-cyclohexyl-2-(5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-8-oxidanylidene-1,7-dihydropurine-6-carboxamide Openeye Name: (2E)-9-cyclohexyl-2-(5-ethoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-8-oxo-1,7-dihydropurine-6-carboxamide CAS Name: (2E)-9-cyclohexyl-2-(5-ethoxy-6-oxo-1-cyclohexa-2,4-dienylidene)-8-oxo-1,7-dihydropurine-6-carboxamide IUPAC Name: (2E)-9-cyclohexyl-2-(5-ethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-8-oxo-1,7-dihydropurine-6-carboxamide Traditional Name: (2E)-9-cyclohexyl-2-(5-ethoxy-6-keto-cyclohexa-2,4-dien-1-ylidene)-8-keto-1,7-dihydropurine-6-carboxamide Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C2NC(=C3C(=N2)N(C(=O)N3)C4CCCCC4)C(=O)N)C1=O

Isomeric SMILES

CCOC1=CC=C/C(=C\2/NC(=C3C(=N2)N(C(=O)N3)C4CCCCC4)C(=O)N)/C1=O

InChI

InChI=1S/C20H23N5O4/c1-2-29-13-10-6-9-12(16(13)26)18-22-14(17(21)27)15-19(24-18)25(20(28)23-15)11-7-4-3-5-8-11/h6,9-11,22H,2-5,7-8H2,1H3,(H2,21,27)(H,23,28)/b18-12+