2-[[1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanyl-butanoyl]piperidin-4-yl]carbonylamino]ethanoate

Systemtic Name: 2-[[1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanyl-butanoyl]piperidin-4-yl]carbonylamino]ethanoate Openeye Name: 2-[[1-[(2S)-2-(tert-butoxycarbonylamino)-4-methylsulfanyl-butanoyl]piperidine-4-carbonyl]amino]acetate CAS Name: 2-[[[1-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(methylthio)-1-oxobutyl]-4-piperidinyl]-oxomethyl]amino]acetate IUPAC Name: 2-[[1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoyl]piperidine-4-carbonyl]amino]acetate Traditional Name: 2-[[1-[(2S)-2-(tert-butoxycarbonylamino)-4-(methylthio)butanoyl]isonipecotoyl]amino]acetate Formula: C18H30N3O6S- MolecularWeight: 416.5123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCSC)C(=O)N1CCC(CC1)C(=O)NCC(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCSC)C(=O)N1CCC(CC1)C(=O)NCC(=O)[O-]

InChI

InChI=1S/C18H31N3O6S/c1-18(2,3)27-17(26)20-13(7-10-28-4)16(25)21-8-5-12(6-9-21)15(24)19-11-14(22)23/h12-13H,5-11H2,1-4H3,(H,19,24)(H,20,26)(H,22,23)/p-1/t13-/m0/s1