O1-tert-butyl O2-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[2-(2-methylsulfanylanilino)-2-oxo-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-[2-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[2-(2-methylsulfanylanilino)-2-oxoethyl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-keto-2-[2-(methylthio)anilino]ethyl] ester Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)OCC(=O)NC2=CC=CC=C2SC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCC(=O)NC2=CC=CC=C2SC

InChI

InChI=1S/C19H26N2O5S/c1-19(2,3)26-18(24)21-11-7-9-14(21)17(23)25-12-16(22)20-13-8-5-6-10-15(13)27-4/h5-6,8,10,14H,7,9,11-12H2,1-4H3,(H,20,22)/t14-/m0/s1