1-(4-bromophenyl)-3-[2-[5-(dimethylsulfamoyl)benzotriazol-1-yl]ethyl]urea

Systemtic Name: 1-(4-bromophenyl)-3-[2-[5-(dimethylsulfamoyl)benzotriazol-1-yl]ethyl]urea Openeye Name: 1-(4-bromophenyl)-3-[2-[5-(dimethylsulfamoyl)benzotriazol-1-yl]ethyl]urea CAS Name: 1-(4-bromophenyl)-3-[2-[5-(dimethylsulfamoyl)-1-benzotriazolyl]ethyl]urea IUPAC Name: 1-(4-bromophenyl)-3-[2-[5-(dimethylsulfamoyl)benzotriazol-1-yl]ethyl]urea Traditional Name: 1-(4-bromophenyl)-3-[2-[5-(dimethylsulfamoyl)benzotriazol-1-yl]ethyl]urea Formula: C17H19BrN6O3S MolecularWeight: 467.34016

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N(N=N2)CCNC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N(N=N2)CCNC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H19BrN6O3S/c1-23(2)28(26,27)14-7-8-16-15(11-14)21-22-24(16)10-9-19-17(25)20-13-5-3-12(18)4-6-13/h3-8,11H,9-10H2,1-2H3,(H2,19,20,25)