[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C16H16FNO4S MolecularWeight: 337.365943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16FNO4S/c17-12-3-5-14(6-4-12)23-9-7-16(20)22-11-15(19)18-10-13-2-1-8-21-13/h1-6,8H,7,9-11H2,(H,18,19)