4-bromanyl-N,N-bis(pyridin-2-ylmethyl)-2-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: 4-bromanyl-N,N-bis(pyridin-2-ylmethyl)-2-(trifluoromethyloxy)benzenesulfonamide Openeye Name: 4-bromo-N,N-bis(2-pyridylmethyl)-2-(trifluoromethoxy)benzenesulfonamide CAS Name: 4-bromo-N,N-bis(2-pyridinylmethyl)-2-(trifluoromethoxy)benzenesulfonamide IUPAC Name: 4-bromo-N,N-bis(pyridin-2-ylmethyl)-2-(trifluoromethoxy)benzenesulfonamide Traditional Name: 4-bromo-N,N-bis(2-pyridylmethyl)-2-(trifluoromethoxy)benzenesulfonamide Formula: C19H15BrF3N3O3S MolecularWeight: 502.30491

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN(CC2=CC=CC=N2)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

Isomeric SMILES

C1=CC=NC(=C1)CN(CC2=CC=CC=N2)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

InChI

InChI=1S/C19H15BrF3N3O3S/c20-14-7-8-18(17(11-14)29-19(21,22)23)30(27,28)26(12-15-5-1-3-9-24-15)13-16-6-2-4-10-25-16/h1-11H,12-13H2