methyl (3R)-1-phenyl-5-sulfanylidene-pyrrolidine-3-carboxylate

Systemtic Name: methyl (3R)-1-phenyl-5-sulfanylidene-pyrrolidine-3-carboxylate Openeye Name: methyl (3R)-1-phenyl-5-thioxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-phenyl-5-sulfanylidene-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3R)-1-phenyl-5-sulfanylidenepyrrolidine-3-carboxylate Traditional Name: (3R)-1-phenyl-5-thioxo-pyrrolidine-3-carboxylic acid methyl ester Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=S)N(C1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H]1CC(=S)N(C1)C2=CC=CC=C2

InChI

InChI=1S/C12H13NO2S/c1-15-12(14)9-7-11(16)13(8-9)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3/t9-/m1/s1