ethyl 4-fluoranyl-3-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[(1,1,3-triketo-1,2-benzothiazol-2-yl)methyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C19H14FNO5S2 MolecularWeight: 419.446563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C19H14FNO5S2/c1-2-26-19(23)17-12(16-13(20)7-5-8-14(16)27-17)10-21-18(22)11-6-3-4-9-15(11)28(21,24)25/h3-9H,2,10H2,1H3