(2S,4S)-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-[(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-[(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-1-(3-acetylsulfanyl-2-methyl-propanoyl)-4-[(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-1-[3-(acetylthio)-2-methyl-1-oxopropyl]-4-[(2-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-1-(3-acetylsulfanyl-2-methylpropanoyl)-4-[(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-1-[3-(acetylthio)-2-methyl-propanoyl]-4-o-anisyl-proline Formula: C19H25NO5S MolecularWeight: 379.4705

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)CC2=CC=CC=C2OC

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1C[C@H](C[C@H]1C(=O)O)CC2=CC=CC=C2OC

InChI

InChI=1S/C19H25NO5S/c1-12(11-26-13(2)21)18(22)20-10-14(9-16(20)19(23)24)8-15-6-4-5-7-17(15)25-3/h4-7,12,14,16H,8-11H2,1-3H3,(H,23,24)/t12?,14-,16-/m0/s1