4-[[2-[3-(dimethylamino)phenoxy]-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]-2-methyl-benzenecarbonitrile

Systemtic Name: 4-[[2-[3-(dimethylamino)phenoxy]-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]-2-methyl-benzenecarbonitrile Openeye Name: 4-[[2-[3-(dimethylamino)phenoxy]-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-2-methyl-benzonitrile CAS Name: 4-[[2-[3-(dimethylamino)phenoxy]-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-2-methylbenzonitrile IUPAC Name: 4-[[2-[3-(dimethylamino)phenoxy]-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-2-methylbenzonitrile Traditional Name: 4-[[2-[3-(dimethylamino)phenoxy]-6-keto-7,8-dihydro-5H-pteridin-4-yl]oxy]-2-methyl-benzonitrile Formula: C22H20N6O3 MolecularWeight: 416.4326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC(=NC3=C2NC(=O)CN3)OC4=CC=CC(=C4)N(C)C)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC(=NC3=C2NC(=O)CN3)OC4=CC=CC(=C4)N(C)C)C#N

InChI

InChI=1S/C22H20N6O3/c1-13-9-17(8-7-14(13)11-23)30-21-19-20(24-12-18(29)25-19)26-22(27-21)31-16-6-4-5-15(10-16)28(2)3/h4-10H,12H2,1-3H3,(H,25,29)(H,24,26,27)