3-(3-bromophenyl)-5-[(1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 3-(3-bromophenyl)-5-[(1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-(3-bromophenyl)-5-[(1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 3-(3-bromophenyl)-5-[[(1-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-bromophenyl)-5-[(1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-(3-bromophenyl)-5-[[(1-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1,2,4-oxadiazole Formula: C17H12BrN5OS MolecularWeight: 414.27908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NC(=N2)SCC3=NC(=NO3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=NC(=N2)SCC3=NC(=NO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C17H12BrN5OS/c18-13-6-4-5-12(9-13)16-20-15(24-22-16)10-25-17-19-11-23(21-17)14-7-2-1-3-8-14/h1-9,11H,10H2