(2-benzamido-2-oxidanylidene-ethyl) (2S)-2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) (2S)-2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: (2-benzamido-2-oxo-ethyl) (2S)-2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanylpropanoate CAS Name: (2S)-2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]propanoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) (2S)-2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylpropanoate Traditional Name: (2S)-2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]propionic acid (2-benzamido-2-keto-ethyl) ester Formula: C20H19FN2O5S MolecularWeight: 418.438663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC(=O)C1=CC=CC=C1)SCC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC(=O)C1=CC=CC=C1)SCC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C20H19FN2O5S/c1-13(29-12-18(25)22-16-9-7-15(21)8-10-16)20(27)28-11-17(24)23-19(26)14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H,22,25)(H,23,24,26)/t13-/m0/s1