[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-(4-fluorophenyl)sulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C18H18FNO3S MolecularWeight: 347.403823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18FNO3S/c19-15-6-8-16(9-7-15)24-11-10-18(22)23-13-17(21)20-12-14-4-2-1-3-5-14/h1-9H,10-13H2,(H,20,21)