ethyl 3-[[[5-(cyclopropylsulfamoyl)-2-methoxy-phenyl]amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-[[[5-(cyclopropylsulfamoyl)-2-methoxy-phenyl]amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[[5-(cyclopropylsulfamoyl)-2-methoxy-anilino]methyl]-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-[[5-(cyclopropylsulfamoyl)-2-methoxyanilino]methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[5-(cyclopropylsulfamoyl)-2-methoxyanilino]methyl]-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-[[5-(cyclopropylsulfamoyl)-2-methoxy-anilino]methyl]-4-fluoro-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=C(C=CC(=C3)S(=O)(=O)NC4CC4)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CNC3=C(C=CC(=C3)S(=O)(=O)NC4CC4)OC

InChI

InChI=1S/C22H23FN2O5S2/c1-3-30-22(26)21-15(20-16(23)5-4-6-19(20)31-21)12-24-17-11-14(9-10-18(17)29-2)32(27,28)25-13-7-8-13/h4-6,9-11,13,24-25H,3,7-8,12H2,1-2H3