methyl 1-butyl-3-methyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: methyl 1-butyl-3-methyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: methyl 1-butyl-3-methyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-butyl-3-methyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-butyl-3-methyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-butyl-3-methyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid methyl ester Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C3=CC=CS3)C(=O)OC

Isomeric SMILES

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C17H19N3O2S/c1-4-5-8-20-16-15(11(2)19-20)12(17(21)22-3)10-13(18-16)14-7-6-9-23-14/h6-7,9-10H,4-5,8H2,1-3H3