(2-oxidanylidene-2-phenylazanyl-ethyl) 3-(4-fluorophenyl)sulfanylpropanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: (2-anilino-2-oxo-ethyl) 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid (2-anilino-2-keto-ethyl) ester Formula: C17H16FNO3S MolecularWeight: 333.377243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)COC(=O)CCSC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)COC(=O)CCSC2=CC=C(C=C2)F

InChI

InChI=1S/C17H16FNO3S/c18-13-6-8-15(9-7-13)23-11-10-17(21)22-12-16(20)19-14-4-2-1-3-5-14/h1-9H,10-12H2,(H,19,20)