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

Systemtic Name: 1-(5-methylsulfonylpyridin-2-yl)-5-(propan-2-ylamino)-3-(trifluoromethyl)pyrazole-4-carbaldehyde Openeye Name: 5-(isopropylamino)-1-(5-methylsulfonyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbaldehyde CAS Name: 1-(5-methylsulfonyl-2-pyridinyl)-5-(propan-2-ylamino)-3-(trifluoromethyl)-4-pyrazolecarboxaldehyde IUPAC Name: 1-(5-methylsulfonylpyridin-2-yl)-5-(propan-2-ylamino)-3-(trifluoromethyl)pyrazole-4-carbaldehyde Traditional Name: 5-(isopropylamino)-1-(5-mesyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbaldehyde Formula: C14H15F3N4O3S MolecularWeight: 376.35411

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C(=NN1C2=NC=C(C=C2)S(=O)(=O)C)C(F)(F)F)C=O

Isomeric SMILES

CC(C)NC1=C(C(=NN1C2=NC=C(C=C2)S(=O)(=O)C)C(F)(F)F)C=O

InChI

InChI=1S/C14H15F3N4O3S/c1-8(2)19-13-10(7-22)12(14(15,16)17)20-21(13)11-5-4-9(6-18-11)25(3,23)24/h4-8,19H,1-3H3