3-[bis(fluoranyl)methyl]-5-(5-fluoranyl-1,3-benzothiazol-2-yl)-2-pyrazol-1-yl-benzenesulfonamide

Systemtic Name: 3-[bis(fluoranyl)methyl]-5-(5-fluoranyl-1,3-benzothiazol-2-yl)-2-pyrazol-1-yl-benzenesulfonamide Openeye Name: 3-(difluoromethyl)-5-(5-fluoro-1,3-benzothiazol-2-yl)-2-pyrazol-1-yl-benzenesulfonamide CAS Name: 3-(difluoromethyl)-5-(5-fluoro-1,3-benzothiazol-2-yl)-2-(1-pyrazolyl)benzenesulfonamide IUPAC Name: 3-(difluoromethyl)-5-(5-fluoro-1,3-benzothiazol-2-yl)-2-pyrazol-1-ylbenzenesulfonamide Traditional Name: 3-(difluoromethyl)-5-(5-fluoro-1,3-benzothiazol-2-yl)-2-pyrazol-1-yl-benzenesulfonamide Formula: C17H11F3N4O2S2 MolecularWeight: 424.42005

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=C(C=C(C=C2S(=O)(=O)N)C3=NC4=C(S3)C=CC(=C4)F)C(F)F

Isomeric SMILES

C1=CN(N=C1)C2=C(C=C(C=C2S(=O)(=O)N)C3=NC4=C(S3)C=CC(=C4)F)C(F)F

InChI

InChI=1S/C17H11F3N4O2S2/c18-10-2-3-13-12(8-10)23-17(27-13)9-6-11(16(19)20)15(24-5-1-4-22-24)14(7-9)28(21,25)26/h1-8,16H,(H2,21,25,26)