(2S)-2-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2-(2-chloro-6-fluorophenyl)-1-oxoethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-4-(methylthio)butyrate Formula: C13H14ClFNO3S- MolecularWeight: 318.771563

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)CC1=C(C=CC=C1Cl)F

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)CC1=C(C=CC=C1Cl)F

InChI

InChI=1S/C13H15ClFNO3S/c1-20-6-5-11(13(18)19)16-12(17)7-8-9(14)3-2-4-10(8)15/h2-4,11H,5-7H2,1H3,(H,16,17)(H,18,19)/p-1/t11-/m0/s1