(2S)-2-azanyl-5-[[(2R)-3-ethanoylsulfanyl-1-ethoxy-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[[(2R)-3-ethanoylsulfanyl-1-ethoxy-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-5-[[(1R)-1-(acetylsulfanylmethyl)-2-ethoxy-2-oxo-ethyl]amino]-2-amino-5-oxo-pentanoic acid CAS Name: (2S)-5-[[(2R)-3-(acetylthio)-1-ethoxy-1-oxopropan-2-yl]amino]-2-amino-5-oxopentanoic acid IUPAC Name: (2S)-5-[[(2R)-3-acetylsulfanyl-1-ethoxy-1-oxopropan-2-yl]amino]-2-amino-5-oxopentanoic acid Traditional Name: (2S)-5-[[(1R)-1-[(acetylthio)methyl]-2-ethoxy-2-keto-ethyl]amino]-2-amino-5-keto-valeric acid Formula: C12H20N2O6S MolecularWeight: 320.362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSC(=O)C)NC(=O)CCC(C(=O)O)N

Isomeric SMILES

CCOC(=O)[C@H](CSC(=O)C)NC(=O)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C12H20N2O6S/c1-3-20-12(19)9(6-21-7(2)15)14-10(16)5-4-8(13)11(17)18/h8-9H,3-6,13H2,1-2H3,(H,14,16)(H,17,18)/t8-,9-/m0/s1