methyl (2S,5S)-5-ethyl-2-(2-phenylsulfanylethyl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,5S)-5-ethyl-2-(2-phenylsulfanylethyl)pyrrolidine-2-carboxylate Openeye Name: methyl (2S,5S)-5-ethyl-2-(2-phenylsulfanylethyl)pyrrolidine-2-carboxylate CAS Name: (2S,5S)-5-ethyl-2-[2-(phenylthio)ethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,5S)-5-ethyl-2-(2-phenylsulfanylethyl)pyrrolidine-2-carboxylate Traditional Name: (2S,5S)-5-ethyl-2-[2-(phenylthio)ethyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C16H23NO2S MolecularWeight: 293.42432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(N1)(CCSC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC[C@H]1CC[C@](N1)(CCSC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C16H23NO2S/c1-3-13-9-10-16(17-13,15(18)19-2)11-12-20-14-7-5-4-6-8-14/h4-8,13,17H,3,9-12H2,1-2H3/t13-,16-/m0/s1