[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(thiophen-2-ylsulfonylamino)propanoate

Systemtic Name: [2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(thiophen-2-ylsulfonylamino)propanoate Openeye Name: [2-[(2-fluorophenyl)methylamino]-2-oxo-ethyl] 3-(2-thienylsulfonylamino)propanoate CAS Name: 3-(thiophen-2-ylsulfonylamino)propanoic acid [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] 3-(thiophen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-thienylsulfonylamino)propionic acid [2-[(2-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C16H17FN2O5S2 MolecularWeight: 400.444983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)COC(=O)CCNS(=O)(=O)C2=CC=CS2)F

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)COC(=O)CCNS(=O)(=O)C2=CC=CS2)F

InChI

InChI=1S/C16H17FN2O5S2/c17-13-5-2-1-4-12(13)10-18-14(20)11-24-15(21)7-8-19-26(22,23)16-6-3-9-25-16/h1-6,9,19H,7-8,10-11H2,(H,18,20)