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

Systemtic Name: 3-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]butanoic acid Openeye Name: 3-[[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]amino]butanoic acid CAS Name: 3-[[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethyl]amino]butanoic acid IUPAC Name: 3-[[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]amino]butanoic acid Traditional Name: 3-[[2-[(5-chloro-2-thienyl)methylthio]acetyl]amino]butyric acid Formula: C11H14ClNO3S2 MolecularWeight: 307.81676

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)CSCC1=CC=C(S1)Cl

Isomeric SMILES

CC(CC(=O)O)NC(=O)CSCC1=CC=C(S1)Cl

InChI

InChI=1S/C11H14ClNO3S2/c1-7(4-11(15)16)13-10(14)6-17-5-8-2-3-9(12)18-8/h2-3,7H,4-6H2,1H3,(H,13,14)(H,15,16)