4-[[(4-bromophenyl)methyl-(4-tert-butylphenyl)sulfonyl-amino]methyl]-N-oxidanidyl-benzamide

Systemtic Name: 4-[[(4-bromophenyl)methyl-(4-tert-butylphenyl)sulfonyl-amino]methyl]-N-oxidanidyl-benzamide Openeye Name: 4-[[(4-bromophenyl)methyl-(4-tert-butylphenyl)sulfonyl-amino]methyl]-N-oxido-benzamide CAS Name: 4-[[(4-bromophenyl)methyl-(4-tert-butylphenyl)sulfonylamino]methyl]-N-oxidobenzamide IUPAC Name: 4-[[(4-bromophenyl)methyl-(4-tert-butylphenyl)sulfonylamino]methyl]-N-oxidobenzamide Traditional Name: 4-[[(4-bromobenzyl)-(4-tert-butylphenyl)sulfonyl-amino]methyl]-N-oxido-benzamide Formula: C25H26BrN2O4S- MolecularWeight: 530.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)N[O-])CC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)N[O-])CC3=CC=C(C=C3)Br

InChI

InChI=1S/C25H26BrN2O4S/c1-25(2,3)21-10-14-23(15-11-21)33(31,32)28(17-19-6-12-22(26)13-7-19)16-18-4-8-20(9-5-18)24(29)27-30/h4-15H,16-17H2,1-3H3,(H-,27,29,30)/q-1