4-[5-(2-benzothiophen-1-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[5-(2-benzothiophen-1-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[5-(2-benzothiophen-1-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[5-(2-benzothiophen-1-yl)-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[5-(2-benzothiophen-1-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-isobenzothiophen-1-yl-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Formula: C18H12F3N3O2S2 MolecularWeight: 423.43199

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CSC(=C2C=C1)C3=CC(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)(F)F

Isomeric SMILES

C1=CC2=CSC(=C2C=C1)C3=CC(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)(F)F

InChI

InChI=1S/C18H12F3N3O2S2/c19-18(20,21)16-9-15(17-14-4-2-1-3-11(14)10-27-17)24(23-16)12-5-7-13(8-6-12)28(22,25)26/h1-10H,(H2,22,25,26)