6-(5-chloranylthiophen-2-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 6-(5-chloranylthiophen-2-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 6-(5-chloro-2-thienyl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 6-(5-chloro-2-thiophenyl)-1,3-dimethyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 6-(5-chlorothiophen-2-yl)-1,3-dimethylpyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 6-(5-chloro-2-thienyl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C13H10ClN3O2S MolecularWeight: 307.7554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)O)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)O)C

InChI

InChI=1S/C13H10ClN3O2S/c1-6-11-7(13(18)19)5-8(9-3-4-10(14)20-9)15-12(11)17(2)16-6/h3-5H,1-2H3,(H,18,19)