2-methylpropyl (2S)-4-methylsulfanyl-2-(prop-2-enoxycarbonylamino)butanoate

Systemtic Name: 2-methylpropyl (2S)-4-methylsulfanyl-2-(prop-2-enoxycarbonylamino)butanoate Openeye Name: isobutyl (2S)-2-(allyloxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-4-(methylthio)-2-[[oxo(prop-2-enoxy)methyl]amino]butanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2S)-4-methylsulfanyl-2-(prop-2-enoxycarbonylamino)butanoate Traditional Name: (2S)-2-(allyloxycarbonylamino)-4-(methylthio)butyric acid isobutyl ester Formula: C13H23NO4S MolecularWeight: 289.39102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(CCSC)NC(=O)OCC=C

Isomeric SMILES

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

InChI

InChI=1S/C13H23NO4S/c1-5-7-17-13(16)14-11(6-8-19-4)12(15)18-9-10(2)3/h5,10-11H,1,6-9H2,2-4H3,(H,14,16)/t11-/m0/s1