ethyl 3-[(4-ethylphenyl)sulfamoyl]-4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-[(4-ethylphenyl)sulfamoyl]-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[(4-ethylphenyl)sulfamoyl]-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-[(4-ethylphenyl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-ethylphenyl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-[(4-ethylphenyl)sulfamoyl]-4-fluoro-benzothiophene-2-carboxylic acid ethyl ester Formula: C19H18FNO4S2 MolecularWeight: 407.478923

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(SC3=CC=CC(=C32)F)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(SC3=CC=CC(=C32)F)C(=O)OCC

InChI

InChI=1S/C19H18FNO4S2/c1-3-12-8-10-13(11-9-12)21-27(23,24)18-16-14(20)6-5-7-15(16)26-17(18)19(22)25-4-2/h5-11,21H,3-4H2,1-2H3