butyl (2S)-4-methylsulfanyl-2-[3-(phenylcarbonylsulfanyl)propanoylamino]butanoate

Systemtic Name: butyl (2S)-4-methylsulfanyl-2-[3-(phenylcarbonylsulfanyl)propanoylamino]butanoate Openeye Name: butyl (2S)-2-(3-benzoylsulfanylpropanoylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[3-(benzoylthio)-1-oxopropyl]amino]-4-(methylthio)butanoic acid butyl ester IUPAC Name: butyl (2S)-2-(3-benzoylsulfanylpropanoylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[3-(benzoylthio)propanoylamino]-4-(methylthio)butyric acid butyl ester Formula: C19H27NO4S2 MolecularWeight: 397.55198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CCSC)NC(=O)CCSC(=O)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C19H27NO4S2/c1-3-4-12-24-18(22)16(10-13-25-2)20-17(21)11-14-26-19(23)15-8-6-5-7-9-15/h5-9,16H,3-4,10-14H2,1-2H3,(H,20,21)/t16-/m0/s1