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

Systemtic Name: methyl 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: methyl 1-(1,1-dioxothiolan-3-yl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-(1,1-dioxo-3-thiolanyl)-3-methyl-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-(1,1-dioxothiolan-3-yl)-3-methyl-6-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(1,1-diketothiolan-3-yl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid methyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)OC)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)OC)C4CCS(=O)(=O)C4

InChI

InChI=1S/C19H19N3O4S/c1-12-17-15(19(23)26-2)10-16(13-6-4-3-5-7-13)20-18(17)22(21-12)14-8-9-27(24,25)11-14/h3-7,10,14H,8-9,11H2,1-2H3