(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 1-(3,4-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(3,4-dimethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)OCC3=NOC(=C3)C4=CC=CS4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)OCC3=NOC(=C3)C4=CC=CS4)C

InChI

InChI=1S/C21H20N2O4S/c1-13-5-6-17(8-14(13)2)23-11-15(9-20(23)24)21(25)26-12-16-10-18(27-22-16)19-4-3-7-28-19/h3-8,10,15H,9,11-12H2,1-2H3