3-[bis(fluoranyl)methyl]-5-(6-methyl-1,3-benzothiazol-2-yl)-2-pyrazol-1-yl-benzenesulfonamide

Systemtic Name: 3-[bis(fluoranyl)methyl]-5-(6-methyl-1,3-benzothiazol-2-yl)-2-pyrazol-1-yl-benzenesulfonamide Openeye Name: 3-(difluoromethyl)-5-(6-methyl-1,3-benzothiazol-2-yl)-2-pyrazol-1-yl-benzenesulfonamide CAS Name: 3-(difluoromethyl)-5-(6-methyl-1,3-benzothiazol-2-yl)-2-(1-pyrazolyl)benzenesulfonamide IUPAC Name: 3-(difluoromethyl)-5-(6-methyl-1,3-benzothiazol-2-yl)-2-pyrazol-1-ylbenzenesulfonamide Traditional Name: 3-(difluoromethyl)-5-(6-methyl-1,3-benzothiazol-2-yl)-2-pyrazol-1-yl-benzenesulfonamide Formula: C18H14F2N4O2S2 MolecularWeight: 420.456166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC(=C(C(=C3)S(=O)(=O)N)N4C=CC=N4)C(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC(=C(C(=C3)S(=O)(=O)N)N4C=CC=N4)C(F)F

InChI

InChI=1S/C18H14F2N4O2S2/c1-10-3-4-13-14(7-10)27-18(23-13)11-8-12(17(19)20)16(24-6-2-5-22-24)15(9-11)28(21,25)26/h2-9,17H,1H3,(H2,21,25,26)