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

Systemtic Name: 3-[[4-(3-azanyl-4-cyano-phenoxy)-6-oxidanylidene-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide Openeye Name: 3-[[4-(3-amino-4-cyano-phenoxy)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide CAS Name: 3-[[4-(3-amino-4-cyanophenoxy)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[[4-(3-amino-4-cyanophenoxy)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethylbenzamide Traditional Name: 3-[[4-(3-amino-4-cyano-phenoxy)-6-keto-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide Formula: C22H19N7O4 MolecularWeight: 445.43076

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=CC(=C(C=C4)C#N)N)NC(=O)CN3

Isomeric SMILES

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

InChI

InChI=1S/C22H19N7O4/c1-29(2)21(31)12-4-3-5-14(8-12)33-22-27-19-18(26-17(30)11-25-19)20(28-22)32-15-7-6-13(10-23)16(24)9-15/h3-9H,11,24H2,1-2H3,(H,26,30)(H,25,27,28)