(4-cyano-2-fluoranyl-phenyl)methyl 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate

Systemtic Name: (4-cyano-2-fluoranyl-phenyl)methyl 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Openeye Name: (4-cyano-2-fluoro-phenyl)methyl 3-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propanoate CAS Name: 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoic acid (4-cyano-2-fluorophenyl)methyl ester IUPAC Name: (4-cyano-2-fluorophenyl)methyl 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Traditional Name: 3-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propionic acid (4-cyano-2-fluoro-benzyl) ester Formula: C17H12FN3O4S MolecularWeight: 373.358283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NN(C(=O)O2)CCC(=O)OCC3=C(C=C(C=C3)C#N)F

Isomeric SMILES

C1=CSC(=C1)C2=NN(C(=O)O2)CCC(=O)OCC3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C17H12FN3O4S/c18-13-8-11(9-19)3-4-12(13)10-24-15(22)5-6-21-17(23)25-16(20-21)14-2-1-7-26-14/h1-4,7-8H,5-6,10H2