ethyl 1,3-dimethyl-4-pyridin-2-ylsulfanyl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 1,3-dimethyl-4-pyridin-2-ylsulfanyl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 1,3-dimethyl-4-(2-pyridylsulfanyl)pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1,3-dimethyl-4-(2-pyridinylthio)-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1,3-dimethyl-4-pyridin-2-ylsulfanylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1,3-dimethyl-4-(2-pyridylthio)pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1SC3=CC=CC=N3)C(=NN2C)C

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1SC3=CC=CC=N3)C(=NN2C)C

InChI

InChI=1S/C16H16N4O2S/c1-4-22-16(21)11-9-18-15-13(10(2)19-20(15)3)14(11)23-12-7-5-6-8-17-12/h5-9H,4H2,1-3H3