2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(2-methylpropylcarbamoyl)ethanamide

Systemtic Name: 2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(2-methylpropylcarbamoyl)ethanamide Openeye Name: N-(isobutylcarbamoyl)-2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: 2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-[(2-methylpropylamino)-oxomethyl]acetamide IUPAC Name: 2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(2-methylpropylcarbamoyl)acetamide Traditional Name: N-(isobutylcarbamoyl)-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C13H18N6O3 MolecularWeight: 306.32042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)CN1C=NC2=C(C1=O)C=NN2C

Isomeric SMILES

CC(C)CNC(=O)NC(=O)CN1C=NC2=C(C1=O)C=NN2C

InChI

InChI=1S/C13H18N6O3/c1-8(2)4-14-13(22)17-10(20)6-19-7-15-11-9(12(19)21)5-16-18(11)3/h5,7-8H,4,6H2,1-3H3,(H2,14,17,20,22)