1-methylsulfonyl-5-[(phenylmethylsulfanyl)methyl]pyrrolidine-3-thiol

Systemtic Name: 1-methylsulfonyl-5-[(phenylmethylsulfanyl)methyl]pyrrolidine-3-thiol Openeye Name: 5-(benzylsulfanylmethyl)-1-methylsulfonyl-pyrrolidine-3-thiol CAS Name: 1-methylsulfonyl-5-[(phenylmethylthio)methyl]-3-pyrrolidinethiol IUPAC Name: 5-(benzylsulfanylmethyl)-1-methylsulfonylpyrrolidine-3-thiol Traditional Name: 5-[(benzylthio)methyl]-1-mesyl-pyrrolidine-3-thiol Formula: C13H19NO2S3 MolecularWeight: 317.49046

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC(CC1CSCC2=CC=CC=C2)S

Isomeric SMILES

CS(=O)(=O)N1CC(CC1CSCC2=CC=CC=C2)S

InChI

InChI=1S/C13H19NO2S3/c1-19(15,16)14-8-13(17)7-12(14)10-18-9-11-5-3-2-4-6-11/h2-6,12-13,17H,7-10H2,1H3