(2S)-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-oxidanyl-4-prop-2-ynyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-oxidanyl-4-prop-2-ynyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-(3-acetylsulfanyl-2-methyl-propanoyl)-4-hydroxy-4-prop-2-ynyl-pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[3-(acetylthio)-2-methyl-1-oxopropyl]-4-hydroxy-4-prop-2-ynyl-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(3-acetylsulfanyl-2-methylpropanoyl)-4-hydroxy-4-prop-2-ynylpyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[3-(acetylthio)-2-methyl-propanoyl]-4-hydroxy-4-propargyl-proline Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)(CC#C)O

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1CC(C[C@H]1C(=O)O)(CC#C)O

InChI

InChI=1S/C14H19NO5S/c1-4-5-14(20)6-11(13(18)19)15(8-14)12(17)9(2)7-21-10(3)16/h1,9,11,20H,5-8H2,2-3H3,(H,18,19)/t9?,11-,14?/m0/s1