9-(3-methoxyphenyl)-8-oxidanylidene-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide

Systemtic Name: 9-(3-methoxyphenyl)-8-oxidanylidene-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Openeye Name: 9-(3-methoxyphenyl)-8-oxo-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide CAS Name: 9-(3-methoxyphenyl)-8-oxo-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide IUPAC Name: 9-(3-methoxyphenyl)-8-oxo-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Traditional Name: 8-keto-9-(3-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Formula: C22H21N5O6 MolecularWeight: 451.43204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

COC1=CC=CC(=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C22H21N5O6/c1-30-13-7-5-6-12(10-13)27-21-17(25-22(27)29)16(19(23)28)24-20(26-21)11-8-14(31-2)18(33-4)15(9-11)32-3/h5-10H,1-4H3,(H2,23,28)(H,25,29)