ethyl 4-fluoranyl-3-[[(3-morpholin-4-ylsulfonylphenyl)amino]methyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[[(3-morpholin-4-ylsulfonylphenyl)amino]methyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[(3-morpholinosulfonylanilino)methyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[[3-(4-morpholinylsulfonyl)anilino]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[(3-morpholin-4-ylsulfonylanilino)methyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[(3-morpholinosulfonylanilino)methyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C22H23FN2O5S2 MolecularWeight: 478.556823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CNC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CNC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H23FN2O5S2/c1-2-30-22(26)21-17(20-18(23)7-4-8-19(20)31-21)14-24-15-5-3-6-16(13-15)32(27,28)25-9-11-29-12-10-25/h3-8,13,24H,2,9-12,14H2,1H3