[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-methylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-methylsulfonylbenzoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C15H15NO5S2 MolecularWeight: 353.4133

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NCC2=CC=CS2

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NCC2=CC=CS2

InChI

InChI=1S/C15H15NO5S2/c1-23(19,20)13-6-2-4-11(8-13)15(18)21-10-14(17)16-9-12-5-3-7-22-12/h2-8H,9-10H2,1H3,(H,16,17)