[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1,3-dimethyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)C1=CN=C2C(=C1)C(=NN2C)C

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)C1=CN=C2C(=C1)C(=NN2C)C

InChI

InChI=1S/C16H21N5O4/c1-4-5-6-17-16(24)19-13(22)9-25-15(23)11-7-12-10(2)20-21(3)14(12)18-8-11/h7-8H,4-6,9H2,1-3H3,(H2,17,19,22,24)