N-(2-bromoethyl)-2-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfonyl-propanamide

Systemtic Name: N-(2-bromoethyl)-2-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfonyl-propanamide Openeye Name: N-(2-bromoethyl)-2-methyl-2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]propanamide CAS Name: N-(2-bromoethyl)-2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]propanamide IUPAC Name: N-(2-bromoethyl)-2-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylpropanamide Traditional Name: N-(2-bromoethyl)-2-methyl-2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]propionamide Formula: C12H14BrF3N2O3S MolecularWeight: 403.21537

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NCCBr)S(=O)(=O)C1=NC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(C)(C(=O)NCCBr)S(=O)(=O)C1=NC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C12H14BrF3N2O3S/c1-11(2,10(19)17-6-5-13)22(20,21)9-4-3-8(7-18-9)12(14,15)16/h3-4,7H,5-6H2,1-2H3,(H,17,19)