(phenylmethyl) (2S)-5-ethanoylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: (phenylmethyl) (2S)-5-ethanoylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: benzyl (2S)-5-acetylsulfanyl-2-(tert-butoxycarbonylamino)pentanoate CAS Name: (2S)-5-(acetylthio)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-5-acetylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (2S)-5-(acetylthio)-2-(tert-butoxycarbonylamino)valeric acid benzyl ester Formula: C19H27NO5S MolecularWeight: 381.48638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCC(C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)SCCC[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H27NO5S/c1-14(21)26-12-8-11-16(20-18(23)25-19(2,3)4)17(22)24-13-15-9-6-5-7-10-15/h5-7,9-10,16H,8,11-13H2,1-4H3,(H,20,23)/t16-/m0/s1