1-methylsulfonyl-5-(phenoxymethyl)pyrrolidine-3-thiol

Systemtic Name: 1-methylsulfonyl-5-(phenoxymethyl)pyrrolidine-3-thiol Openeye Name: 1-methylsulfonyl-5-(phenoxymethyl)pyrrolidine-3-thiol CAS Name: 1-methylsulfonyl-5-(phenoxymethyl)-3-pyrrolidinethiol IUPAC Name: 1-methylsulfonyl-5-(phenoxymethyl)pyrrolidine-3-thiol Traditional Name: 1-mesyl-5-(phenoxymethyl)pyrrolidine-3-thiol Formula: C12H17NO3S2 MolecularWeight: 287.39828

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC(CC1COC2=CC=CC=C2)S

Isomeric SMILES

CS(=O)(=O)N1CC(CC1COC2=CC=CC=C2)S

InChI

InChI=1S/C12H17NO3S2/c1-18(14,15)13-8-12(17)7-10(13)9-16-11-5-3-2-4-6-11/h2-6,10,12,17H,7-9H2,1H3