methyl 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-cyclopropyl-3-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: methyl 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-cyclopropyl-3-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: methyl 6-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-3-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-cyclopropyl-1-(1,1-dioxo-3-thiolanyl)-3-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-3-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-cyclopropyl-1-(1,1-diketothiolan-3-yl)-3-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid methyl ester Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NC2=C1C(=NN2C3CCS(=O)(=O)C3)C4=CC=CS4)C5CC5

Isomeric SMILES

COC(=O)C1=CC(=NC2=C1C(=NN2C3CCS(=O)(=O)C3)C4=CC=CS4)C5CC5

InChI

InChI=1S/C19H19N3O4S2/c1-26-19(23)13-9-14(11-4-5-11)20-18-16(13)17(15-3-2-7-27-15)21-22(18)12-6-8-28(24,25)10-12/h2-3,7,9,11-12H,4-6,8,10H2,1H3