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

Systemtic Name: 9-(4-ethoxyphenyl)-2-(1H-indol-3-yl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(4-ethoxyphenyl)-2-(1H-indol-3-yl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(4-ethoxyphenyl)-2-(1H-indol-3-yl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(4-ethoxyphenyl)-2-(1H-indol-3-yl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-(1H-indol-3-yl)-8-keto-9-p-phenetyl-7H-purine-6-carboxamide Formula: C22H18N6O3 MolecularWeight: 414.41672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CNC5=CC=CC=C54

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C22H18N6O3/c1-2-31-13-9-7-12(8-10-13)28-21-18(26-22(28)30)17(19(23)29)25-20(27-21)15-11-24-16-6-4-3-5-14(15)16/h3-11,24H,2H2,1H3,(H2,23,29)(H,26,30)