2-methylpropyl 6-(3-oxidanylidene-4,6-dihydro-1H-thieno[3,4-c]pyrazol-2-yl)pyridine-3-carboxylate

Systemtic Name: 2-methylpropyl 6-(3-oxidanylidene-4,6-dihydro-1H-thieno[3,4-c]pyrazol-2-yl)pyridine-3-carboxylate Openeye Name: isobutyl 6-(3-oxo-4,6-dihydro-1H-thieno[3,4-c]pyrazol-2-yl)pyridine-3-carboxylate CAS Name: 6-(3-oxo-4,6-dihydro-1H-thieno[3,4-c]pyrazol-2-yl)-3-pyridinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 6-(3-oxo-4,6-dihydro-1H-thieno[3,4-c]pyrazol-2-yl)pyridine-3-carboxylate Traditional Name: 6-(3-keto-4,6-dihydro-1H-thieno[3,4-c]pyrazol-2-yl)nicotinic acid isobutyl ester Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CN=C(C=C1)N2C(=O)C3=C(N2)CSC3

Isomeric SMILES

CC(C)COC(=O)C1=CN=C(C=C1)N2C(=O)C3=C(N2)CSC3

InChI

InChI=1S/C15H17N3O3S/c1-9(2)6-21-15(20)10-3-4-13(16-5-10)18-14(19)11-7-22-8-12(11)17-18/h3-5,9,17H,6-8H2,1-2H3