4-[6,6-dimethyl-4-oxidanylidene-3-(trifluoromethyl)-5,7-dihydroindazol-1-yl]-2-(thian-4-ylamino)benzamide

Systemtic Name: 4-[6,6-dimethyl-4-oxidanylidene-3-(trifluoromethyl)-5,7-dihydroindazol-1-yl]-2-(thian-4-ylamino)benzamide Openeye Name: 4-[6,6-dimethyl-4-oxo-3-(trifluoromethyl)-5,7-dihydroindazol-1-yl]-2-(tetrahydrothiopyran-4-ylamino)benzamide CAS Name: 4-[6,6-dimethyl-4-oxo-3-(trifluoromethyl)-5,7-dihydroindazol-1-yl]-2-(4-thianylamino)benzamide IUPAC Name: 4-[6,6-dimethyl-4-oxo-3-(trifluoromethyl)-5,7-dihydroindazol-1-yl]-2-(thian-4-ylamino)benzamide Traditional Name: 4-[4-keto-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydroindazol-1-yl]-2-(tetrahydrothiopyran-4-ylamino)benzamide Formula: C22H25F3N4O2S MolecularWeight: 466.51971

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=NN2C3=CC(=C(C=C3)C(=O)N)NC4CCSCC4)C(F)(F)F)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=NN2C3=CC(=C(C=C3)C(=O)N)NC4CCSCC4)C(F)(F)F)C

InChI

InChI=1S/C22H25F3N4O2S/c1-21(2)10-16-18(17(30)11-21)19(22(23,24)25)28-29(16)13-3-4-14(20(26)31)15(9-13)27-12-5-7-32-8-6-12/h3-4,9,12,27H,5-8,10-11H2,1-2H3,(H2,26,31)