methyl (2S)-4-methylsulfanyl-2-(2-phenylsulfanylethanoylamino)butanoate

Systemtic Name: methyl (2S)-4-methylsulfanyl-2-(2-phenylsulfanylethanoylamino)butanoate Openeye Name: methyl (2S)-4-methylsulfanyl-2-[(2-phenylsulfanylacetyl)amino]butanoate CAS Name: (2S)-4-(methylthio)-2-[[1-oxo-2-(phenylthio)ethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-4-methylsulfanyl-2-[(2-phenylsulfanylacetyl)amino]butanoate Traditional Name: (2S)-4-(methylthio)-2-[[2-(phenylthio)acetyl]amino]butyric acid methyl ester Formula: C14H19NO3S2 MolecularWeight: 313.43556

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)CSC1=CC=CC=C1

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)CSC1=CC=CC=C1

InChI

InChI=1S/C14H19NO3S2/c1-18-14(17)12(8-9-19-2)15-13(16)10-20-11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3,(H,15,16)/t12-/m0/s1