2-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-[(5-chloro-2-thienyl)methylthio]acetyl]amino]-4-(methylthio)butyric acid Formula: C12H16ClNO3S3 MolecularWeight: 353.90834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClNO3S3/c1-18-5-4-9(12(16)17)14-11(15)7-19-6-8-2-3-10(13)20-8/h2-3,9H,4-7H2,1H3,(H,14,15)(H,16,17)