(2S)-1-(4-ethanoylsulfanylbutanoyl)-4-(4-methylphenyl)-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-(4-ethanoylsulfanylbutanoyl)-4-(4-methylphenyl)-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-(4-acetylsulfanylbutanoyl)-4-hydroxy-4-(p-tolyl)pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[4-(acetylthio)-1-oxobutyl]-4-hydroxy-4-(4-methylphenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(4-acetylsulfanylbutanoyl)-4-hydroxy-4-(4-methylphenyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[4-(acetylthio)butanoyl]-4-hydroxy-4-(p-tolyl)proline Formula: C18H23NO5S MolecularWeight: 365.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CC(N(C2)C(=O)CCCSC(=O)C)C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2(C[C@H](N(C2)C(=O)CCCSC(=O)C)C(=O)O)O

InChI

InChI=1S/C18H23NO5S/c1-12-5-7-14(8-6-12)18(24)10-15(17(22)23)19(11-18)16(21)4-3-9-25-13(2)20/h5-8,15,24H,3-4,9-11H2,1-2H3,(H,22,23)/t15-,18?/m0/s1