[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 6-methyl-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H25N5O4 MolecularWeight: 375.4222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N5O4/c1-5-6-7-19-18(26)22-15(24)10-27-17(25)14-8-13-9-20-23(11(2)3)16(13)21-12(14)4/h8-9,11H,5-7,10H2,1-4H3,(H2,19,22,24,26)