(2S)-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2S)-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylamino]-4-methylsulfanyl-butanoic acid Openeye Name: (2S)-2-[3-(tert-butoxycarbonylamino)propylamino]-4-methylsulfanyl-butanoic acid CAS Name: (2S)-2-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propylamino]-4-(methylthio)butanoic acid IUPAC Name: (2S)-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylamino]-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-[3-(tert-butoxycarbonylamino)propylamino]-4-(methylthio)butyric acid Formula: C13H26N2O4S MolecularWeight: 306.42154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCNC(CCSC)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCCN[C@@H](CCSC)C(=O)O

InChI

InChI=1S/C13H26N2O4S/c1-13(2,3)19-12(18)15-8-5-7-14-10(11(16)17)6-9-20-4/h10,14H,5-9H2,1-4H3,(H,15,18)(H,16,17)/t10-/m0/s1