3-[[4-(5-cyano-2-oxidanyl-phenoxy)-6-oxidanylidene-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide

Systemtic Name: 3-[[4-(5-cyano-2-oxidanyl-phenoxy)-6-oxidanylidene-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide Openeye Name: 3-[[4-(5-cyano-2-hydroxy-phenoxy)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide CAS Name: 3-[[4-(5-cyano-2-hydroxyphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[[4-(5-cyano-2-hydroxyphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethylbenzamide Traditional Name: 3-[[4-(5-cyano-2-hydroxy-phenoxy)-6-keto-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide Formula: C22H18N6O5 MolecularWeight: 446.41552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=CC=C1)OC2=NC3=C(C(=N2)OC4=C(C=CC(=C4)C#N)O)NC(=O)CN3

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)OC2=NC3=C(C(=N2)OC4=C(C=CC(=C4)C#N)O)NC(=O)CN3

InChI

InChI=1S/C22H18N6O5/c1-28(2)21(31)13-4-3-5-14(9-13)32-22-26-19-18(25-17(30)11-24-19)20(27-22)33-16-8-12(10-23)6-7-15(16)29/h3-9,29H,11H2,1-2H3,(H,25,30)(H,24,26,27)