ethyl 4-fluoranyl-3-[2-(furan-2-ylcarbonylamino)propanoyloxymethyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[2-(furan-2-ylcarbonylamino)propanoyloxymethyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[2-(furan-2-carbonylamino)propanoyloxymethyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[[2-[[2-furanyl(oxo)methyl]amino]-1-oxopropoxy]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[2-(furan-2-carbonylamino)propanoyloxymethyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[2-(2-furoylamino)propanoyloxymethyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C20H18FNO6S MolecularWeight: 419.423423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)C(C)NC(=O)C3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)C(C)NC(=O)C3=CC=CO3

InChI

InChI=1S/C20H18FNO6S/c1-3-26-20(25)17-12(16-13(21)6-4-8-15(16)29-17)10-28-19(24)11(2)22-18(23)14-7-5-9-27-14/h4-9,11H,3,10H2,1-2H3,(H,22,23)