methyl 2-phenylsulfanylpyrrolidine-1-carboxylate

Systemtic Name: methyl 2-phenylsulfanylpyrrolidine-1-carboxylate Openeye Name: methyl 2-phenylsulfanylpyrrolidine-1-carboxylate CAS Name: 2-(phenylthio)-1-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-phenylsulfanylpyrrolidine-1-carboxylate Traditional Name: 2-(phenylthio)pyrrolidine-1-carboxylic acid methyl ester Formula: C12H15NO2S MolecularWeight: 237.318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCCC1SC2=CC=CC=C2

Isomeric SMILES

COC(=O)N1CCCC1SC2=CC=CC=C2

InChI

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