3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole

Systemtic Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole Openeye Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(2-thienyl)-1H-1,2,4-triazole CAS Name: 3-[2-(4-bromophenyl)sulfonylethylthio]-5-thiophen-2-yl-1H-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole Traditional Name: 3-(2-brosylethylthio)-5-(2-thienyl)-1H-1,2,4-triazole Formula: C14H12BrN3O2S3 MolecularWeight: 430.36298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NN2)SCCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NN2)SCCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C14H12BrN3O2S3/c15-10-3-5-11(6-4-10)23(19,20)9-8-22-14-16-13(17-18-14)12-2-1-7-21-12/h1-7H,8-9H2,(H,16,17,18)