N-(4-bromanyl-3-methyl-phenyl)-2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[[6-(dimethylsulfamoyl)-1-benzotriazolyl]oxy]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxyacetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-acetamide Formula: C17H18BrN5O4S MolecularWeight: 468.32492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CON2C3=C(C=CC(=C3)S(=O)(=O)N(C)C)N=N2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CON2C3=C(C=CC(=C3)S(=O)(=O)N(C)C)N=N2)Br

InChI

InChI=1S/C17H18BrN5O4S/c1-11-8-12(4-6-14(11)18)19-17(24)10-27-23-16-9-13(28(25,26)22(2)3)5-7-15(16)20-21-23/h4-9H,10H2,1-3H3,(H,19,24)