[2-[(3-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate

Systemtic Name: [2-[(3-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: [2-[(3-chlorophenyl)methylamino]-2-oxo-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid [2-[(3-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(3-chlorophenyl)methylamino]-2-oxoethyl] 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid [2-[(3-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C18H17ClFNO3S MolecularWeight: 381.848883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CNC(=O)COC(=O)CCSC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CNC(=O)COC(=O)CCSC2=CC=C(C=C2)F

InChI

InChI=1S/C18H17ClFNO3S/c19-14-3-1-2-13(10-14)11-21-17(22)12-24-18(23)8-9-25-16-6-4-15(20)5-7-16/h1-7,10H,8-9,11-12H2,(H,21,22)