3-(thiophen-2-ylsulfanylmethyl)benzoic acid

Systemtic Name: 3-(thiophen-2-ylsulfanylmethyl)benzoic acid Openeye Name: 3-(2-thienylsulfanylmethyl)benzoic acid CAS Name: 3-[(thiophen-2-ylthio)methyl]benzoic acid IUPAC Name: 3-(thiophen-2-ylsulfanylmethyl)benzoic acid Traditional Name: 3-[(2-thienylthio)methyl]benzoic acid Formula: C12H10O2S2 MolecularWeight: 250.3366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=CC=CS2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=CC=CS2)C(=O)O

InChI

InChI=1S/C12H10O2S2/c13-12(14)10-4-1-3-9(7-10)8-16-11-5-2-6-15-11/h1-7H,8H2,(H,13,14)