5-ethoxy-4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanyl-butanoyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-ethoxy-4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanyl-butanoyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-[[2-(tert-butoxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]-5-ethoxy-5-oxo-pentanoic acid CAS Name: 5-ethoxy-4-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(methylthio)-1-oxobutyl]amino]-5-oxopentanoic acid IUPAC Name: 5-ethoxy-4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoyl]amino]-5-oxopentanoic acid Traditional Name: 4-[[2-(tert-butoxycarbonylamino)-4-(methylthio)butanoyl]amino]-5-ethoxy-5-keto-valeric acid Formula: C17H30N2O7S MolecularWeight: 406.4943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)O)NC(=O)C(CCSC)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CCC(=O)O)NC(=O)C(CCSC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H30N2O7S/c1-6-25-15(23)12(7-8-13(20)21)18-14(22)11(9-10-27-5)19-16(24)26-17(2,3)4/h11-12H,6-10H2,1-5H3,(H,18,22)(H,19,24)(H,20,21)