6-pyridin-3-yl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 6-pyridin-3-yl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 6-(3-pyridyl)-1-(2-thienylmethyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 6-(3-pyridinyl)-1-(thiophen-2-ylmethyl)-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 6-pyridin-3-yl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 6-(3-pyridyl)-1-(2-thenyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C17H12N4O2S MolecularWeight: 336.36778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC3=C(C=NN3CC4=CC=CS4)C(=C2)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)C2=NC3=C(C=NN3CC4=CC=CS4)C(=C2)C(=O)O

InChI

InChI=1S/C17H12N4O2S/c22-17(23)13-7-15(11-3-1-5-18-8-11)20-16-14(13)9-19-21(16)10-12-4-2-6-24-12/h1-9H,10H2,(H,22,23)