4-(4-bromophenyl)-5-[(4-chloranylphenoxy)methyl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-bromophenyl)-5-[(4-chloranylphenoxy)methyl]-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-bromophenyl)-5-[(4-chlorophenoxy)methyl]-1,2,4-triazole-3-thiolate CAS Name: 4-(4-bromophenyl)-5-[(4-chlorophenoxy)methyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-bromophenyl)-5-[(4-chlorophenoxy)methyl]-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-bromophenyl)-5-[(4-chlorophenoxy)methyl]-1,2,4-triazole-3-thiolate Formula: C15H10BrClN3OS- MolecularWeight: 395.6814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=NN=C2[S-])COC3=CC=C(C=C3)Cl)Br

Isomeric SMILES

C1=CC(=CC=C1N2C(=NN=C2[S-])COC3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C15H11BrClN3OS/c16-10-1-5-12(6-2-10)20-14(18-19-15(20)22)9-21-13-7-3-11(17)4-8-13/h1-8H,9H2,(H,19,22)/p-1