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

Systemtic Name: ethyl 3-[[2-(5-cyano-2-methyl-phenoxy)-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-methyl-benzoate Openeye Name: ethyl 3-[[2-(5-cyano-2-methyl-phenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-methyl-benzoate CAS Name: 3-[[2-(5-cyano-2-methylphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(5-cyano-2-methylphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-methylbenzoate Traditional Name: 3-[[2-(5-cyano-2-methyl-phenoxy)-6-keto-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-methyl-benzoic acid ethyl ester Formula: C24H21N5O5 MolecularWeight: 459.45404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N5O5/c1-4-32-23(31)16-7-13(2)8-17(10-16)33-22-20-21(26-12-19(30)27-20)28-24(29-22)34-18-9-15(11-25)6-5-14(18)3/h5-10H,4,12H2,1-3H3,(H,27,30)(H,26,28,29)