N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-3-carboxamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-3-carboxamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-3-carboxamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-[[3-(trifluoromethyl)phenoxy]methyl]-3-pyrazolecarboxamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-3-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-3-carboxamide Formula: C20H15F3N4O4S2 MolecularWeight: 496.48271

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C=C3)COC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C=C3)COC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C20H15F3N4O4S2/c1-33(29,30)14-5-6-15-17(10-14)32-19(24-15)25-18(28)16-7-8-27(26-16)11-31-13-4-2-3-12(9-13)20(21,22)23/h2-10H,11H2,1H3,(H,24,25,28)