N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide Openeye Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide CAS Name: N-(4-bromo-3-methyl-5-isoxazolyl)-3,5-bis(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide Traditional Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide Formula: C12H7BrF6N2O3S MolecularWeight: 453.154999

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1Br)NS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=NOC(=C1Br)NS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C12H7BrF6N2O3S/c1-5-9(13)10(24-20-5)21-25(22,23)8-3-6(11(14,15)16)2-7(4-8)12(17,18)19/h2-4,21H,1H3