methyl (2S,4R)-4-phenylsulfanylpyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R)-4-phenylsulfanylpyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R)-4-phenylsulfanylpyrrolidine-2-carboxylate CAS Name: (2S,4R)-4-(phenylthio)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-4-phenylsulfanylpyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-(phenylthio)pyrrolidine-2-carboxylic acid methyl ester Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1)SC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H]1C[C@H](CN1)SC2=CC=CC=C2

InChI

InChI=1S/C12H15NO2S/c1-15-12(14)11-7-10(8-13-11)16-9-5-3-2-4-6-9/h2-6,10-11,13H,7-8H2,1H3/t10-,11+/m1/s1