4-[[(3-bromophenyl)methyl-[3-(trifluoromethyl)phenyl]sulfonyl-amino]methyl]-N-oxidanidyl-benzamide

Systemtic Name: 4-[[(3-bromophenyl)methyl-[3-(trifluoromethyl)phenyl]sulfonyl-amino]methyl]-N-oxidanidyl-benzamide Openeye Name: 4-[[(3-bromophenyl)methyl-[3-(trifluoromethyl)phenyl]sulfonyl-amino]methyl]-N-oxido-benzamide CAS Name: 4-[[(3-bromophenyl)methyl-[3-(trifluoromethyl)phenyl]sulfonylamino]methyl]-N-oxidobenzamide IUPAC Name: 4-[[(3-bromophenyl)methyl-[3-(trifluoromethyl)phenyl]sulfonylamino]methyl]-N-oxidobenzamide Traditional Name: 4-[[(3-bromobenzyl)-[3-(trifluoromethyl)phenyl]sulfonyl-amino]methyl]-N-oxido-benzamide Formula: C22H17BrF3N2O4S- MolecularWeight: 542.34559

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CN(CC2=CC=C(C=C2)C(=O)N[O-])S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)Br)CN(CC2=CC=C(C=C2)C(=O)N[O-])S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H17BrF3N2O4S/c23-19-5-1-3-16(11-19)14-28(13-15-7-9-17(10-8-15)21(29)27-30)33(31,32)20-6-2-4-18(12-20)22(24,25)26/h1-12H,13-14H2,(H-,27,29,30)/q-1