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

Systemtic Name: (2S)-2-acetamido-5-[[(2R)-3-ethanoylsulfanyl-1-ethoxy-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-acetamido-5-[[(1R)-1-(acetylsulfanylmethyl)-2-ethoxy-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: (2S)-2-acetamido-5-[[(2R)-3-(acetylthio)-1-ethoxy-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: (2S)-2-acetamido-5-[[(2R)-3-acetylsulfanyl-1-ethoxy-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: (2S)-2-acetamido-5-[[(1R)-1-[(acetylthio)methyl]-2-ethoxy-2-keto-ethyl]amino]-5-keto-valeric acid Formula: C14H22N2O7S MolecularWeight: 362.39868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O7S/c1-4-23-14(22)11(7-24-9(3)18)16-12(19)6-5-10(13(20)21)15-8(2)17/h10-11H,4-7H2,1-3H3,(H,15,17)(H,16,19)(H,20,21)/t10-,11-/m0/s1