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

Systemtic Name: 4-methoxy-3-[[2-(3-methylphenoxy)-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]benzenecarbonitrile Openeye Name: 4-methoxy-3-[[2-(3-methylphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]benzonitrile CAS Name: 4-methoxy-3-[[2-(3-methylphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]benzonitrile IUPAC Name: 4-methoxy-3-[[2-(3-methylphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]benzonitrile Traditional Name: 3-[[6-keto-2-(3-methylphenoxy)-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-methoxy-benzonitrile Formula: C21H17N5O4 MolecularWeight: 403.39078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=NC3=C(C(=N2)OC4=C(C=CC(=C4)C#N)OC)NC(=O)CN3

Isomeric SMILES

CC1=CC(=CC=C1)OC2=NC3=C(C(=N2)OC4=C(C=CC(=C4)C#N)OC)NC(=O)CN3

InChI

InChI=1S/C21H17N5O4/c1-12-4-3-5-14(8-12)29-21-25-19-18(24-17(27)11-23-19)20(26-21)30-16-9-13(10-22)6-7-15(16)28-2/h3-9H,11H2,1-2H3,(H,24,27)(H,23,25,26)