ethyl 2-[3-(6-methyl-4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoylamino]ethanoate

Systemtic Name: ethyl 2-[3-(6-methyl-4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoylamino]ethanoate Openeye Name: ethyl 2-[3-(6-methyl-4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoylamino]acetate CAS Name: 2-[[3-(6-methyl-4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)-1-oxopropyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(6-methyl-4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)propanoylamino]acetate Traditional Name: 2-[3-(4-keto-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoylamino]acetic acid ethyl ester Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CCN1C(=NC2=C(C1=O)C=NN2C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)CNC(=O)CCN1C(=NC2=C(C1=O)C=NN2C3=CC=CC=C3)C

InChI

InChI=1S/C19H21N5O4/c1-3-28-17(26)12-20-16(25)9-10-23-13(2)22-18-15(19(23)27)11-21-24(18)14-7-5-4-6-8-14/h4-8,11H,3,9-10,12H2,1-2H3,(H,20,25)