4-[[(4-bromophenyl)sulfonyl-[(2-methylphenyl)methyl]amino]methyl]-N-oxidanidyl-benzamide

Systemtic Name: 4-[[(4-bromophenyl)sulfonyl-[(2-methylphenyl)methyl]amino]methyl]-N-oxidanidyl-benzamide Openeye Name: 4-[[(4-bromophenyl)sulfonyl-(o-tolylmethyl)amino]methyl]-N-oxido-benzamide CAS Name: 4-[[(4-bromophenyl)sulfonyl-[(2-methylphenyl)methyl]amino]methyl]-N-oxidobenzamide IUPAC Name: 4-[[(4-bromophenyl)sulfonyl-[(2-methylphenyl)methyl]amino]methyl]-N-oxidobenzamide Traditional Name: 4-[[brosyl-(2-methylbenzyl)amino]methyl]-N-oxido-benzamide Formula: C22H20BrN2O4S- MolecularWeight: 488.3742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC2=CC=C(C=C2)C(=O)N[O-])S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC=C1CN(CC2=CC=C(C=C2)C(=O)N[O-])S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H20BrN2O4S/c1-16-4-2-3-5-19(16)15-25(30(28,29)21-12-10-20(23)11-13-21)14-17-6-8-18(9-7-17)22(26)24-27/h2-13H,14-15H2,1H3,(H-,24,26,27)/q-1