(phenylmethyl) 3-[azanyl(sulfanyl)methyl]-3-fluoranyl-pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-[azanyl(sulfanyl)methyl]-3-fluoranyl-pyrrolidine-1-carboxylate Openeye Name: benzyl 3-[amino(sulfanyl)methyl]-3-fluoro-pyrrolidine-1-carboxylate CAS Name: 3-[amino(mercapto)methyl]-3-fluoro-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[amino(sulfanyl)methyl]-3-fluoropyrrolidine-1-carboxylate Traditional Name: 3-[amino(mercapto)methyl]-3-fluoro-pyrrolidine-1-carboxylic acid benzyl ester Formula: C13H17FN2O2S MolecularWeight: 284.349683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1(C(N)S)F)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CN(CC1(C(N)S)F)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C13H17FN2O2S/c14-13(11(15)19)6-7-16(9-13)12(17)18-8-10-4-2-1-3-5-10/h1-5,11,19H,6-9,15H2