3-(2-hydroxyethylsulfanylmethyl)-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-(2-hydroxyethylsulfanylmethyl)-1-benzothiophene-2-carboxylic acid Openeye Name: 3-(2-hydroxyethylsulfanylmethyl)benzothiophene-2-carboxylic acid CAS Name: 3-[(2-hydroxyethylthio)methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-(2-hydroxyethylsulfanylmethyl)-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[(2-hydroxyethylthio)methyl]benzothiophene-2-carboxylic acid Formula: C12H12O3S2 MolecularWeight: 268.35188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)O)CSCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)O)CSCCO

InChI

InChI=1S/C12H12O3S2/c13-5-6-16-7-9-8-3-1-2-4-10(8)17-11(9)12(14)15/h1-4,13H,5-7H2,(H,14,15)