methyl 1-butyl-6-(1,3-dimethylpyrazol-4-yl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: methyl 1-butyl-6-(1,3-dimethylpyrazol-4-yl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: methyl 1-butyl-6-(1,3-dimethylpyrazol-4-yl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-butyl-6-(1,3-dimethyl-4-pyrazolyl)-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-butyl-6-(1,3-dimethylpyrazol-4-yl)-3-methylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-butyl-6-(1,3-dimethylpyrazol-4-yl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid methyl ester Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C3=CN(N=C3C)C)C(=O)OC

Isomeric SMILES

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C3=CN(N=C3C)C)C(=O)OC

InChI

InChI=1S/C18H23N5O2/c1-6-7-8-23-17-16(12(3)21-23)13(18(24)25-5)9-15(19-17)14-10-22(4)20-11(14)2/h9-10H,6-8H2,1-5H3