[3-(dimethylsulfamoyl)phenyl]methyl 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [3-(dimethylsulfamoyl)phenyl]methyl 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [3-(dimethylsulfamoyl)phenyl]methyl 3-chloro-6-fluoro-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-fluoro-1-benzothiophene-2-carboxylic acid [3-(dimethylsulfamoyl)phenyl]methyl ester IUPAC Name: [3-(dimethylsulfamoyl)phenyl]methyl 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-fluoro-benzothiophene-2-carboxylic acid [3-(dimethylsulfamoyl)benzyl] ester Formula: C18H15ClFNO4S2 MolecularWeight: 427.897403

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)COC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)COC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C18H15ClFNO4S2/c1-21(2)27(23,24)13-5-3-4-11(8-13)10-25-18(22)17-16(19)14-7-6-12(20)9-15(14)26-17/h3-9H,10H2,1-2H3