[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-[(3-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-[(3-chlorophenyl)sulfonylamino]propanoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 3-[(3-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(3-chlorophenyl)sulfonylamino]propanoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3-[(3-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(3-chlorophenyl)sulfonylamino]propionic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C16H17ClN2O5S2 MolecularWeight: 416.89958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)S(=O)(=O)NCCC(=O)OCC(=O)NCC2=CC=CS2

Isomeric SMILES

C1=CC(=CC(=C1)Cl)S(=O)(=O)NCCC(=O)OCC(=O)NCC2=CC=CS2

InChI

InChI=1S/C16H17ClN2O5S2/c17-12-3-1-5-14(9-12)26(22,23)19-7-6-16(21)24-11-15(20)18-10-13-4-2-8-25-13/h1-5,8-9,19H,6-7,10-11H2,(H,18,20)