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

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-[methyl(phenyl)sulfamoyl]benzoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 4-[methyl(phenyl)sulfamoyl]benzoate CAS Name: 4-[methyl(phenyl)sulfamoyl]benzoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-[methyl(phenyl)sulfamoyl]benzoate Traditional Name: 4-[methyl(phenyl)sulfamoyl]benzoic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C22H18N2O5S2 MolecularWeight: 454.51872

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C22H18N2O5S2/c1-24(18-6-3-2-4-7-18)31(26,27)19-11-9-16(10-12-19)22(25)28-15-17-14-20(29-23-17)21-8-5-13-30-21/h2-14H,15H2,1H3