(2-bromophenyl)methyl-[2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (2-bromophenyl)methyl-[2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (2-bromophenyl)methyl-[2-[5-(diethylsulfamoyl)-2-methyl-anilino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (2-bromophenyl)methyl-[2-[5-(diethylsulfamoyl)-2-methylanilino]-2-oxoethyl]-methylammonium IUPAC Name: (2-bromophenyl)methyl-[2-[5-(diethylsulfamoyl)-2-methylanilino]-2-oxoethyl]-methylazanium Traditional Name: (2-bromobenzyl)-[2-[5-(diethylsulfamoyl)-2-methyl-anilino]-2-keto-ethyl]-methyl-ammonium Formula: C21H29BrN3O3S+ MolecularWeight: 483.44226

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=O)C[NH+](C)CC2=CC=CC=C2Br

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=O)C[NH+](C)CC2=CC=CC=C2Br

InChI

InChI=1S/C21H28BrN3O3S/c1-5-25(6-2)29(27,28)18-12-11-16(3)20(13-18)23-21(26)15-24(4)14-17-9-7-8-10-19(17)22/h7-13H,5-6,14-15H2,1-4H3,(H,23,26)/p+1