5,5-dimethyl-3-thiophen-2-yl-1-[2,2,2-tris(fluoranyl)ethyl]-6,7-dihydroindazol-4-one

Systemtic Name: 5,5-dimethyl-3-thiophen-2-yl-1-[2,2,2-tris(fluoranyl)ethyl]-6,7-dihydroindazol-4-one Openeye Name: 5,5-dimethyl-3-(2-thienyl)-1-(2,2,2-trifluoroethyl)-6,7-dihydroindazol-4-one CAS Name: 5,5-dimethyl-3-thiophen-2-yl-1-(2,2,2-trifluoroethyl)-6,7-dihydroindazol-4-one IUPAC Name: 5,5-dimethyl-3-thiophen-2-yl-1-(2,2,2-trifluoroethyl)-6,7-dihydroindazol-4-one Traditional Name: 5,5-dimethyl-3-(2-thienyl)-1-(2,2,2-trifluoroethyl)-6,7-dihydroindazol-4-one Formula: C15H15F3N2OS MolecularWeight: 328.35261

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(C1=O)C(=NN2CC(F)(F)F)C3=CC=CS3)C

Isomeric SMILES

CC1(CCC2=C(C1=O)C(=NN2CC(F)(F)F)C3=CC=CS3)C

InChI

InChI=1S/C15H15F3N2OS/c1-14(2)6-5-9-11(13(14)21)12(10-4-3-7-22-10)19-20(9)8-15(16,17)18/h3-4,7H,5-6,8H2,1-2H3