2-bromanyl-4,5-dimethoxy-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide

Systemtic Name: 2-bromanyl-4,5-dimethoxy-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide Openeye Name: 2-bromo-4,5-dimethoxy-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide CAS Name: 2-bromo-4,5-dimethoxy-N-[3-[3-(methylthio)-1,2,4-triazol-4-yl]phenyl]benzenesulfonamide IUPAC Name: 2-bromo-4,5-dimethoxy-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide Traditional Name: 2-bromo-4,5-dimethoxy-N-[3-[3-(methylthio)-1,2,4-triazol-4-yl]phenyl]benzenesulfonamide Formula: C17H17BrN4O4S2 MolecularWeight: 485.37528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)NC2=CC=CC(=C2)N3C=NN=C3SC

Isomeric SMILES

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)NC2=CC=CC(=C2)N3C=NN=C3SC

InChI

InChI=1S/C17H17BrN4O4S2/c1-25-14-8-13(18)16(9-15(14)26-2)28(23,24)21-11-5-4-6-12(7-11)22-10-19-20-17(22)27-3/h4-10,21H,1-3H3