4-(thiophen-2-ylmethylsulfanyl)benzoic acid

Systemtic Name: 4-(thiophen-2-ylmethylsulfanyl)benzoic acid Openeye Name: 4-(2-thienylmethylsulfanyl)benzoic acid CAS Name: 4-(thiophen-2-ylmethylthio)benzoic acid IUPAC Name: 4-(thiophen-2-ylmethylsulfanyl)benzoic acid Traditional Name: 4-(2-thenylthio)benzoic acid Formula: C12H10O2S2 MolecularWeight: 250.3366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CSC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CSC(=C1)CSC2=CC=C(C=C2)C(=O)O

InChI

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