(2S)-4,4-bis(ethylsulfanyl)-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-4,4-bis(ethylsulfanyl)-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S)-4,4-bis(ethylsulfanyl)-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid CAS Name: (2S)-4,4-bis(ethylthio)-1-(3-mercapto-2-methyl-1-oxopropyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-4,4-bis(ethylsulfanyl)-1-(2-methyl-3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-4,4-bis(ethylthio)-1-(3-mercapto-2-methyl-propanoyl)proline Formula: C13H23NO3S3 MolecularWeight: 337.52162

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1(CC(N(C1)C(=O)C(C)CS)C(=O)O)SCC

Isomeric SMILES

CCSC1(C[C@H](N(C1)C(=O)C(C)CS)C(=O)O)SCC

InChI

InChI=1S/C13H23NO3S3/c1-4-19-13(20-5-2)6-10(12(16)17)14(8-13)11(15)9(3)7-18/h9-10,18H,4-8H2,1-3H3,(H,16,17)/t9?,10-/m0/s1