5-[3-(2-bromanyl-4-methyl-phenoxy)propyl]-4-ethyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[3-(2-bromanyl-4-methyl-phenoxy)propyl]-4-ethyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[3-(2-bromo-4-methyl-phenoxy)propyl]-4-ethyl-1,2,4-triazole-3-thiolate CAS Name: 5-[3-(2-bromo-4-methylphenoxy)propyl]-4-ethyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[3-(2-bromo-4-methylphenoxy)propyl]-4-ethyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[3-(2-bromo-4-methyl-phenoxy)propyl]-4-ethyl-1,2,4-triazole-3-thiolate Formula: C14H17BrN3OS- MolecularWeight: 355.27328

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1[S-])CCCOC2=C(C=C(C=C2)C)Br

Isomeric SMILES

CCN1C(=NN=C1[S-])CCCOC2=C(C=C(C=C2)C)Br

InChI

InChI=1S/C14H18BrN3OS/c1-3-18-13(16-17-14(18)20)5-4-8-19-12-7-6-10(2)9-11(12)15/h6-7,9H,3-5,8H2,1-2H3,(H,17,20)/p-1