5-(4-bromophenyl)-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-(4-bromophenyl)-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-(4-bromophenyl)-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(4-bromophenyl)-3-(2-phenoxyethylthio)-1H-1,2,4-triazole IUPAC Name: 5-(4-bromophenyl)-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-(4-bromophenyl)-3-(2-phenoxyethylthio)-1H-1,2,4-triazole Formula: C16H14BrN3OS MolecularWeight: 376.27086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCSC2=NNC(=N2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)OCCSC2=NNC(=N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H14BrN3OS/c17-13-8-6-12(7-9-13)15-18-16(20-19-15)22-11-10-21-14-4-2-1-3-5-14/h1-9H,10-11H2,(H,18,19,20)