ethyl 4-[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]ethyl]-2-sulfanylidene-pyrrolidine-3-carboxylate

Systemtic Name: ethyl 4-[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]ethyl]-2-sulfanylidene-pyrrolidine-3-carboxylate Openeye Name: ethyl 4-[2-(4-tert-butoxycarbonylphenyl)ethyl]-2-thioxo-pyrrolidine-3-carboxylate CAS Name: 4-[2-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]ethyl]-2-sulfanylidene-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]ethyl]-2-sulfanylidenepyrrolidine-3-carboxylate Traditional Name: 4-[2-(4-tert-butoxycarbonylphenyl)ethyl]-2-thioxo-pyrrolidine-3-carboxylic acid ethyl ester Formula: C20H27NO4S MolecularWeight: 377.49768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CNC1=S)CCC2=CC=C(C=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1C(CNC1=S)CCC2=CC=C(C=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H27NO4S/c1-5-24-19(23)16-15(12-21-17(16)26)11-8-13-6-9-14(10-7-13)18(22)25-20(2,3)4/h6-7,9-10,15-16H,5,8,11-12H2,1-4H3,(H,21,26)