3-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]propanoic acid

Systemtic Name: 3-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]propanoic acid Openeye Name: 3-[[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]amino]propanoic acid CAS Name: 3-[[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]amino]propanoic acid Traditional Name: 3-[[2-[(5-chloro-2-thienyl)methylthio]acetyl]amino]propionic acid Formula: C10H12ClNO3S2 MolecularWeight: 293.79018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Cl)CSCC(=O)NCCC(=O)O

Isomeric SMILES

C1=C(SC(=C1)Cl)CSCC(=O)NCCC(=O)O

InChI

InChI=1S/C10H12ClNO3S2/c11-8-2-1-7(17-8)5-16-6-9(13)12-4-3-10(14)15/h1-2H,3-6H2,(H,12,13)(H,14,15)