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

Systemtic Name: pentyl (2S)-4-methylsulfanyl-2-(prop-2-enoxycarbonylamino)butanoate Openeye Name: pentyl (2S)-2-(allyloxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-4-(methylthio)-2-[[oxo(prop-2-enoxy)methyl]amino]butanoic acid pentyl ester IUPAC Name: pentyl (2S)-4-methylsulfanyl-2-(prop-2-enoxycarbonylamino)butanoate Traditional Name: (2S)-2-(allyloxycarbonylamino)-4-(methylthio)butyric acid amyl ester Formula: C14H25NO4S MolecularWeight: 303.4176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(CCSC)NC(=O)OCC=C

Isomeric SMILES

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

InChI

InChI=1S/C14H25NO4S/c1-4-6-7-10-18-13(16)12(8-11-20-3)15-14(17)19-9-5-2/h5,12H,2,4,6-11H2,1,3H3,(H,15,17)/t12-/m0/s1