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

Systemtic Name: 9-(3-methylphenyl)-8-oxidanylidene-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Openeye Name: 9-(m-tolyl)-8-oxo-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide CAS Name: 9-(3-methylphenyl)-8-oxo-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide IUPAC Name: 9-(3-methylphenyl)-8-oxo-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Traditional Name: 8-keto-9-(m-tolyl)-2-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Formula: C22H21N5O5 MolecularWeight: 435.43264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C22H21N5O5/c1-11-6-5-7-13(8-11)27-21-17(25-22(27)29)16(19(23)28)24-20(26-21)12-9-14(30-2)18(32-4)15(10-12)31-3/h5-10H,1-4H3,(H2,23,28)(H,25,29)