[1-[(2-methylsulfanylphenyl)amino]-1-oxidanylidene-propan-2-yl] 5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxylate

Systemtic Name: [1-[(2-methylsulfanylphenyl)amino]-1-oxidanylidene-propan-2-yl] 5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxylate Openeye Name: [1-methyl-2-(2-methylsulfanylanilino)-2-oxo-ethyl] 5-oxo-1-phenethyl-pyrrolidine-3-carboxylate CAS Name: 5-oxo-1-phenethyl-3-pyrrolidinecarboxylic acid [1-[2-(methylthio)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylsulfanylanilino)-1-oxopropan-2-yl] 5-oxo-1-phenethylpyrrolidine-3-carboxylate Traditional Name: 5-keto-1-phenethyl-pyrrolidine-3-carboxylic acid [2-keto-1-methyl-2-[2-(methylthio)anilino]ethyl] ester Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1SC)OC(=O)C2CC(=O)N(C2)CCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1SC)OC(=O)C2CC(=O)N(C2)CCC3=CC=CC=C3

InChI

InChI=1S/C23H26N2O4S/c1-16(22(27)24-19-10-6-7-11-20(19)30-2)29-23(28)18-14-21(26)25(15-18)13-12-17-8-4-3-5-9-17/h3-11,16,18H,12-15H2,1-2H3,(H,24,27)