(phenylmethyl) 3-sulfanylidenepyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 3-sulfanylidenepyrrolidine-2-carboxylate Openeye Name: benzyl 3-thioxopyrrolidine-2-carboxylate CAS Name: 3-sulfanylidene-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-sulfanylidenepyrrolidine-2-carboxylate Traditional Name: 3-thioxopyrrolidine-2-carboxylic acid benzyl ester Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C1=S)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CNC(C1=S)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C12H13NO2S/c14-12(11-10(16)6-7-13-11)15-8-9-4-2-1-3-5-9/h1-5,11,13H,6-8H2