1-(5-methylsulfonylpyridin-2-yl)-5-propan-2-ylsulfanyl-3-(trifluoromethyl)pyrazole-4-carbaldehyde

Systemtic Name: 1-(5-methylsulfonylpyridin-2-yl)-5-propan-2-ylsulfanyl-3-(trifluoromethyl)pyrazole-4-carbaldehyde Openeye Name: 5-isopropylsulfanyl-1-(5-methylsulfonyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbaldehyde CAS Name: 1-(5-methylsulfonyl-2-pyridinyl)-5-(propan-2-ylthio)-3-(trifluoromethyl)-4-pyrazolecarboxaldehyde IUPAC Name: 1-(5-methylsulfonylpyridin-2-yl)-5-propan-2-ylsulfanyl-3-(trifluoromethyl)pyrazole-4-carbaldehyde Traditional Name: 5-(isopropylthio)-1-(5-mesyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbaldehyde Formula: C14H14F3N3O3S2 MolecularWeight: 393.40447

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=C(C(=NN1C2=NC=C(C=C2)S(=O)(=O)C)C(F)(F)F)C=O

Isomeric SMILES

CC(C)SC1=C(C(=NN1C2=NC=C(C=C2)S(=O)(=O)C)C(F)(F)F)C=O

InChI

InChI=1S/C14H14F3N3O3S2/c1-8(2)24-13-10(7-21)12(14(15,16)17)19-20(13)11-5-4-9(6-18-11)25(3,22)23/h4-8H,1-3H3