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

Systemtic Name: 5-(4-bromophenyl)-3-(phenylmethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-(4-bromophenyl)-1H-1,2,4-triazole CAS Name: 5-(4-bromophenyl)-3-(phenylmethylthio)-1H-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-(4-bromophenyl)-1H-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-(4-bromophenyl)-1H-1,2,4-triazole Formula: C15H12BrN3S MolecularWeight: 346.24488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NNC(=N2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NNC(=N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H12BrN3S/c16-13-8-6-12(7-9-13)14-17-15(19-18-14)20-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,17,18,19)