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

Systemtic Name: (2S)-2-acetamido-5-[[(2R)-3-ethanoylsulfanyl-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-acetamido-5-[[(1R)-1-(acetylsulfanylmethyl)-2-hydroxy-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: (2S)-2-acetamido-5-[[(2R)-3-(acetylthio)-1-hydroxy-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: (2S)-2-acetamido-5-[[(2R)-3-acetylsulfanyl-1-hydroxy-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: (2S)-2-acetamido-5-[[(1R)-1-[(acetylthio)methyl]-2-hydroxy-2-keto-ethyl]amino]-5-keto-valeric acid Formula: C12H18N2O7S MolecularWeight: 334.34552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O7S/c1-6(15)13-8(11(18)19)3-4-10(17)14-9(12(20)21)5-22-7(2)16/h8-9H,3-5H2,1-2H3,(H,13,15)(H,14,17)(H,18,19)(H,20,21)/t8-,9-/m0/s1