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

Systemtic Name: ethyl 2-[6-methyl-4-oxidanylidene-2-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-5-yl]ethanoate Openeye Name: ethyl 2-(2-benzyl-6-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetate CAS Name: 2-[6-methyl-4-oxo-2-(phenylmethyl)-5-pyrazolo[3,4-d]pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(2-benzyl-6-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetate Traditional Name: 2-(2-benzyl-4-keto-6-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetic acid ethyl ester Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=NC2=NN(C=C2C1=O)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)CN1C(=NC2=NN(C=C2C1=O)CC3=CC=CC=C3)C

InChI

InChI=1S/C17H18N4O3/c1-3-24-15(22)11-21-12(2)18-16-14(17(21)23)10-20(19-16)9-13-7-5-4-6-8-13/h4-8,10H,3,9,11H2,1-2H3