(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-methylsulfonylbenzoate

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-methylsulfonylbenzoate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid [3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C15H12N2O5S2 MolecularWeight: 364.39618

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=NC(=NO2)C3=CSC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=NC(=NO2)C3=CSC=C3

InChI

InChI=1S/C15H12N2O5S2/c1-24(19,20)12-5-3-2-4-11(12)15(18)21-8-13-16-14(17-22-13)10-6-7-23-9-10/h2-7,9H,8H2,1H3