3-[(2-bromophenyl)methylsulfanylmethyl]-4-[(4-chlorophenyl)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(2-bromophenyl)methylsulfanylmethyl]-4-[(4-chlorophenyl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2-bromophenyl)methylsulfanylmethyl]-4-[(4-chlorophenyl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[[(2-bromophenyl)methylthio]methyl]-4-[(4-chlorophenyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2-bromophenyl)methylsulfanylmethyl]-4-[(4-chlorophenyl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-[[(2-bromobenzyl)thio]methyl]-4-(4-chlorobenzyl)-1H-1,2,4-triazole-5-thione Formula: C17H15BrClN3S2 MolecularWeight: 440.8081

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCC2=NNC(=S)N2CC3=CC=C(C=C3)Cl)Br

Isomeric SMILES

C1=CC=C(C(=C1)CSCC2=NNC(=S)N2CC3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C17H15BrClN3S2/c18-15-4-2-1-3-13(15)10-24-11-16-20-21-17(23)22(16)9-12-5-7-14(19)8-6-12/h1-8H,9-11H2,(H,21,23)