2-(4-ethoxy-3-methoxy-phenyl)-9-(2-ethoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-(4-ethoxy-3-methoxy-phenyl)-9-(2-ethoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-(4-ethoxy-3-methoxy-phenyl)-9-(2-ethoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-(4-ethoxy-3-methoxyphenyl)-9-(2-ethoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-(4-ethoxy-3-methoxyphenyl)-9-(2-ethoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-(4-ethoxy-3-methoxy-phenyl)-8-keto-9-o-phenetyl-7H-purine-6-carboxamide Formula: C23H23N5O5 MolecularWeight: 449.45922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=CC=C4OCC)C(=O)N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=CC=C4OCC)C(=O)N)OC

InChI

InChI=1S/C23H23N5O5/c1-4-32-15-9-7-6-8-14(15)28-22-19(26-23(28)30)18(20(24)29)25-21(27-22)13-10-11-16(33-5-2)17(12-13)31-3/h6-12H,4-5H2,1-3H3,(H2,24,29)(H,26,30)