ethyl (2S)-4-methylsulfanyl-2-[3-(phenylmethylsulfanyl)propanoylamino]butanoate

Systemtic Name: ethyl (2S)-4-methylsulfanyl-2-[3-(phenylmethylsulfanyl)propanoylamino]butanoate Openeye Name: ethyl (2S)-2-(3-benzylsulfanylpropanoylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-4-(methylthio)-2-[[1-oxo-3-(phenylmethylthio)propyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(3-benzylsulfanylpropanoylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[3-(benzylthio)propanoylamino]-4-(methylthio)butyric acid ethyl ester Formula: C17H25NO3S2 MolecularWeight: 355.5153

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)NC(=O)CCSCC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)[C@H](CCSC)NC(=O)CCSCC1=CC=CC=C1

InChI

InChI=1S/C17H25NO3S2/c1-3-21-17(20)15(9-11-22-2)18-16(19)10-12-23-13-14-7-5-4-6-8-14/h4-8,15H,3,9-13H2,1-2H3,(H,18,19)/t15-/m0/s1