2-bromanyl-3,7-diethyl-4-oxidanylidene-thieno[2,3-b]pyridine-5-carboxylic acid

Systemtic Name: 2-bromanyl-3,7-diethyl-4-oxidanylidene-thieno[2,3-b]pyridine-5-carboxylic acid Openeye Name: 2-bromo-3,7-diethyl-4-oxo-thieno[2,3-b]pyridine-5-carboxylic acid CAS Name: 2-bromo-3,7-diethyl-4-oxo-5-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 2-bromo-3,7-diethyl-4-oxothieno[2,3-b]pyridine-5-carboxylic acid Traditional Name: 2-bromo-3,7-diethyl-4-keto-thieno[2,3-b]pyridine-5-carboxylic acid Formula: C12H12BrNO3S MolecularWeight: 330.19758

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)C(=CN2CC)C(=O)O)Br

Isomeric SMILES

CCC1=C(SC2=C1C(=O)C(=CN2CC)C(=O)O)Br

InChI

InChI=1S/C12H12BrNO3S/c1-3-6-8-9(15)7(12(16)17)5-14(4-2)11(8)18-10(6)13/h5H,3-4H2,1-2H3,(H,16,17)