N-(4,6-dimethylpyrimidin-2-yl)-4-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl-(3-methylbutanoylamino)amino]benzenesulfonamide

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl-(3-methylbutanoylamino)amino]benzenesulfonamide Openeye Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[(3-methylbutanoylamino)-[2,2,2-trifluoro-1-(trifluoromethyl)ethyl]amino]benzenesulfonamide CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-4-[1,1,1,3,3,3-hexafluoropropan-2-yl-[(3-methyl-1-oxobutyl)amino]amino]benzenesulfonamide IUPAC Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[1,1,1,3,3,3-hexafluoropropan-2-yl-(3-methylbutanoylamino)amino]benzenesulfonamide Traditional Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[(isovalerylamino)-[2,2,2-trifluoro-1-(trifluoromethyl)ethyl]amino]benzenesulfonamide Formula: C20H23F6N5O3S MolecularWeight: 527.483739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N(C(C(F)(F)F)C(F)(F)F)NC(=O)CC(C)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N(C(C(F)(F)F)C(F)(F)F)NC(=O)CC(C)C)C

InChI

InChI=1S/C20H23F6N5O3S/c1-11(2)9-16(32)29-31(17(19(21,22)23)20(24,25)26)14-5-7-15(8-6-14)35(33,34)30-18-27-12(3)10-13(4)28-18/h5-8,10-11,17H,9H2,1-4H3,(H,29,32)(H,27,28,30)