(2S)-2-(2-chloranylethanoylamino)-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-(2-chloranylethanoylamino)-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[(2-chloroacetyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[(2-chloro-1-oxoethyl)amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[(2-chloroacetyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(2-chloroacetyl)amino]-4-(methylthio)butyrate Formula: C7H11ClNO3S- MolecularWeight: 224.68514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)CCl

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)CCl

InChI

InChI=1S/C7H12ClNO3S/c1-13-3-2-5(7(11)12)9-6(10)4-8/h5H,2-4H2,1H3,(H,9,10)(H,11,12)/p-1/t5-/m0/s1