3-methyl-1-(3-oxidanidyl-3-oxidanylidene-propyl)-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: 3-methyl-1-(3-oxidanidyl-3-oxidanylidene-propyl)-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 3-methyl-1-(3-oxido-3-oxo-propyl)-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 3-methyl-1-(3-oxido-3-oxopropyl)-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 3-methyl-1-(3-oxido-3-oxopropyl)-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(3-keto-3-oxido-propyl)-3-methyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylate Formula: C15H11N3O4S-2 MolecularWeight: 329.33054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)[O-])CCC(=O)[O-]

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)[O-])CCC(=O)[O-]

InChI

InChI=1S/C15H13N3O4S/c1-8-13-9(15(21)22)7-10(11-3-2-6-23-11)16-14(13)18(17-8)5-4-12(19)20/h2-3,6-7H,4-5H2,1H3,(H,19,20)(H,21,22)/p-2