3-ethoxy-4-methylsulfanyl-1-benzothiophene-5-carboxylic acid

Systemtic Name: 3-ethoxy-4-methylsulfanyl-1-benzothiophene-5-carboxylic acid Openeye Name: 3-ethoxy-4-methylsulfanyl-benzothiophene-5-carboxylic acid CAS Name: 3-ethoxy-4-(methylthio)-1-benzothiophene-5-carboxylic acid IUPAC Name: 3-ethoxy-4-methylsulfanyl-1-benzothiophene-5-carboxylic acid Traditional Name: 3-ethoxy-4-(methylthio)benzothiophene-5-carboxylic acid Formula: C12H12O3S2 MolecularWeight: 268.35188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CSC2=C1C(=C(C=C2)C(=O)O)SC

Isomeric SMILES

CCOC1=CSC2=C1C(=C(C=C2)C(=O)O)SC

InChI

InChI=1S/C12H12O3S2/c1-3-15-8-6-17-9-5-4-7(12(13)14)11(16-2)10(8)9/h4-6H,3H2,1-2H3,(H,13,14)