2-[(5-ethylthiophen-2-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(5-ethylthiophen-2-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(5-ethyl-2-thienyl)methylsulfanyl]acetic acid CAS Name: 2-[(5-ethyl-2-thiophenyl)methylthio]acetic acid IUPAC Name: 2-[(5-ethylthiophen-2-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(5-ethyl-2-thienyl)methylthio]acetic acid Formula: C9H12O2S2 MolecularWeight: 216.32038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CSCC(=O)O

Isomeric SMILES

CCC1=CC=C(S1)CSCC(=O)O

InChI

InChI=1S/C9H12O2S2/c1-2-7-3-4-8(13-7)5-12-6-9(10)11/h3-4H,2,5-6H2,1H3,(H,10,11)