[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl (3S)-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl (3S)-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [5-(2-furyl)isoxazol-3-yl]methyl (3S)-1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxylic acid [5-(2-furanyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl (3S)-1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-[3-(methylthio)phenyl]pyrrolidine-3-carboxylic acid [5-(2-furyl)isoxazol-3-yl]methyl ester Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)OCC3=NOC(=C3)C4=CC=CO4

Isomeric SMILES

CSC1=CC=CC(=C1)N2C[C@H](CC2=O)C(=O)OCC3=NOC(=C3)C4=CC=CO4

InChI

InChI=1S/C20H18N2O5S/c1-28-16-5-2-4-15(10-16)22-11-13(8-19(22)23)20(24)26-12-14-9-18(27-21-14)17-6-3-7-25-17/h2-7,9-10,13H,8,11-12H2,1H3/t13-/m0/s1