ethyl (2S,3R)-3-methyl-4-methylsulfanyl-2-propyl-pyrrolidine-1-carboxylate

Systemtic Name: ethyl (2S,3R)-3-methyl-4-methylsulfanyl-2-propyl-pyrrolidine-1-carboxylate Openeye Name: ethyl (2S,3R)-3-methyl-4-methylsulfanyl-2-propyl-pyrrolidine-1-carboxylate CAS Name: (2S,3R)-3-methyl-4-(methylthio)-2-propyl-1-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-3-methyl-4-methylsulfanyl-2-propylpyrrolidine-1-carboxylate Traditional Name: (2S,3R)-3-methyl-4-(methylthio)-2-propyl-pyrrolidine-1-carboxylic acid ethyl ester Formula: C12H23NO2S MolecularWeight: 245.38152

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(CN1C(=O)OCC)SC)C

Isomeric SMILES

CCC[C@H]1[C@H](C(CN1C(=O)OCC)SC)C

InChI

InChI=1S/C12H23NO2S/c1-5-7-10-9(3)11(16-4)8-13(10)12(14)15-6-2/h9-11H,5-8H2,1-4H3/t9-,10+,11?/m1/s1