6-methyl-4-oxidanylidene-5-propyl-thieno[3,2-c]pyridine-2-carboxylic acid

Systemtic Name: 6-methyl-4-oxidanylidene-5-propyl-thieno[3,2-c]pyridine-2-carboxylic acid Openeye Name: 6-methyl-4-oxo-5-propyl-thieno[3,2-c]pyridine-2-carboxylic acid CAS Name: 6-methyl-4-oxo-5-propyl-2-thieno[3,2-c]pyridinecarboxylic acid IUPAC Name: 6-methyl-4-oxo-5-propylthieno[3,2-c]pyridine-2-carboxylic acid Traditional Name: 4-keto-6-methyl-5-propyl-thieno[3,2-c]pyridine-2-carboxylic acid Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC2=C(C1=O)C=C(S2)C(=O)O)C

Isomeric SMILES

CCCN1C(=CC2=C(C1=O)C=C(S2)C(=O)O)C

InChI

InChI=1S/C12H13NO3S/c1-3-4-13-7(2)5-9-8(11(13)14)6-10(17-9)12(15)16/h5-6H,3-4H2,1-2H3,(H,15,16)