N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]-4-chloranyl-3-(diethylsulfamoyl)benzamide

Systemtic Name: N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]-4-chloranyl-3-(diethylsulfamoyl)benzamide Openeye Name: 4-chloro-3-(diethylsulfamoyl)-N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]benzamide CAS Name: 4-chloro-3-(diethylsulfamoyl)-N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 4-chloro-3-(diethylsulfamoyl)-N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]benzamide Traditional Name: 4-chloro-3-(diethylsulfamoyl)-N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C19H18ClF2N3O3S3 MolecularWeight: 506.009326

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)SC(F)F)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)SC(F)F)Cl

InChI

InChI=1S/C19H18ClF2N3O3S3/c1-3-25(4-2)31(27,28)16-9-11(5-7-13(16)20)17(26)24-19-23-14-8-6-12(29-18(21)22)10-15(14)30-19/h5-10,18H,3-4H2,1-2H3,(H,23,24,26)