2-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-[(3-chlorophenyl)methylthio]-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-[(3-chlorobenzyl)thio]acetyl]amino]-4-(methylthio)butyric acid Formula: C14H18ClNO3S2 MolecularWeight: 347.88062

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)CSCC1=CC(=CC=C1)Cl

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)CSCC1=CC(=CC=C1)Cl

InChI

InChI=1S/C14H18ClNO3S2/c1-20-6-5-12(14(18)19)16-13(17)9-21-8-10-3-2-4-11(15)7-10/h2-4,7,12H,5-6,8-9H2,1H3,(H,16,17)(H,18,19)