2-(4-bromophenyl)-3-methyl-4-pyrazol-1-yl-5-(2H-1,2,3-triazol-4-yl)benzenesulfonamide

Systemtic Name: 2-(4-bromophenyl)-3-methyl-4-pyrazol-1-yl-5-(2H-1,2,3-triazol-4-yl)benzenesulfonamide Openeye Name: 2-(4-bromophenyl)-3-methyl-4-pyrazol-1-yl-5-(2H-triazol-4-yl)benzenesulfonamide CAS Name: 2-(4-bromophenyl)-3-methyl-4-(1-pyrazolyl)-5-(2H-triazol-4-yl)benzenesulfonamide IUPAC Name: 2-(4-bromophenyl)-3-methyl-4-pyrazol-1-yl-5-(2H-triazol-4-yl)benzenesulfonamide Traditional Name: 2-(4-bromophenyl)-3-methyl-4-pyrazol-1-yl-5-(2H-triazol-4-yl)benzenesulfonamide Formula: C18H15BrN6O2S MolecularWeight: 459.3197

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1C2=CC=C(C=C2)Br)S(=O)(=O)N)C3=NNN=C3)N4C=CC=N4

Isomeric SMILES

CC1=C(C(=CC(=C1C2=CC=C(C=C2)Br)S(=O)(=O)N)C3=NNN=C3)N4C=CC=N4

InChI

InChI=1S/C18H15BrN6O2S/c1-11-17(12-3-5-13(19)6-4-12)16(28(20,26)27)9-14(15-10-21-24-23-15)18(11)25-8-2-7-22-25/h2-10H,1H3,(H2,20,26,27)(H,21,23,24)