methyl 2-[6-(2-methylpropanoylamino)-4-oxidanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-yl]ethanoate

Systemtic Name: methyl 2-[6-(2-methylpropanoylamino)-4-oxidanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-yl]ethanoate Openeye Name: methyl 2-[6-(2-methylpropanoylamino)-4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-yl]acetate CAS Name: 2-[6-[(2-methyl-1-oxopropyl)amino]-4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-(2-methylpropanoylamino)-4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-yl]acetate Traditional Name: 2-[6-(isobutyrylamino)-4-keto-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-yl]acetic acid methyl ester Formula: C12H15N5O4 MolecularWeight: 293.2786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NC(=O)C2=C(NNC2=N1)CC(=O)OC

Isomeric SMILES

CC(C)C(=O)NC1=NC(=O)C2=C(NNC2=N1)CC(=O)OC

InChI

InChI=1S/C12H15N5O4/c1-5(2)10(19)14-12-13-9-8(11(20)15-12)6(16-17-9)4-7(18)21-3/h5H,4H2,1-3H3,(H3,13,14,15,16,17,19,20)