2-(1H-indol-3-yl)-8-oxidanylidene-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide

Systemtic Name: 2-(1H-indol-3-yl)-8-oxidanylidene-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Openeye Name: 2-(1H-indol-3-yl)-8-oxo-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide CAS Name: 2-(1H-indol-3-yl)-8-oxo-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide IUPAC Name: 2-(1H-indol-3-yl)-8-oxo-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Traditional Name: 2-(1H-indol-3-yl)-8-keto-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Formula: C23H20N6O5 MolecularWeight: 460.4421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CNC5=CC=CC=C54

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C23H20N6O5/c1-32-15-8-11(9-16(33-2)19(15)34-3)29-22-18(27-23(29)31)17(20(24)30)26-21(28-22)13-10-25-14-7-5-4-6-12(13)14/h4-10,25H,1-3H3,(H2,24,30)(H,27,31)