(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-[(4-fluorophenyl)sulfonylamino]benzoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-[(4-fluorophenyl)sulfonylamino]benzoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 4-[(4-fluorophenyl)sulfonylamino]benzoate CAS Name: 4-[(4-fluorophenyl)sulfonylamino]benzoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-[(4-fluorophenyl)sulfonylamino]benzoate Traditional Name: 4-[(4-fluorophenyl)sulfonylamino]benzoic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C21H15FN2O5S2 MolecularWeight: 458.482603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H15FN2O5S2/c22-15-5-9-18(10-6-15)31(26,27)24-16-7-3-14(4-8-16)21(25)28-13-17-12-19(29-23-17)20-2-1-11-30-20/h1-12,24H,13H2