[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(2-fluorophenyl)methylsulfanyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(2-fluorophenyl)methylsulfanyl]benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[(2-fluorophenyl)methylsulfanyl]benzoate CAS Name: 2-[(2-fluorophenyl)methylthio]benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[(2-fluorophenyl)methylsulfanyl]benzoate Traditional Name: 2-[(2-fluorobenzyl)thio]benzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C19H16FNO3S MolecularWeight: 357.398643

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1=CC=CC=C1SCC2=CC=CC=C2F

Isomeric SMILES

C#CCNC(=O)COC(=O)C1=CC=CC=C1SCC2=CC=CC=C2F

InChI

InChI=1S/C19H16FNO3S/c1-2-11-21-18(22)12-24-19(23)15-8-4-6-10-17(15)25-13-14-7-3-5-9-16(14)20/h1,3-10H,11-13H2,(H,21,22)