[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoate

Systemtic Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoate Openeye Name: [5-(2-furyl)isoxazol-3-yl]methyl 2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]benzoic acid [5-(2-furanyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzoate Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]benzoic acid [5-(2-furyl)isoxazol-3-yl]methyl ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)OCC3=NOC(=C3)C4=CC=CO4

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)OCC3=NOC(=C3)C4=CC=CO4

InChI

InChI=1S/C21H20N2O5S/c24-20(23-9-3-4-10-23)14-29-19-8-2-1-6-16(19)21(25)27-13-15-12-18(28-22-15)17-7-5-11-26-17/h1-2,5-8,11-12H,3-4,9-10,13-14H2