[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-(4-fluorophenyl)sulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C15H14FNO3S MolecularWeight: 307.339963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14FNO3S/c16-11-3-5-12(6-4-11)21-9-7-15(19)20-10-14(18)13-2-1-8-17-13/h1-6,8,17H,7,9-10H2