5-[(3-bromanylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(3-bromanylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[(3-bromophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(3-bromophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(3-bromophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(3-bromophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Formula: C15H11BrN3OS- MolecularWeight: 361.23634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2[S-])COC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2[S-])COC3=CC(=CC=C3)Br

InChI

InChI=1S/C15H12BrN3OS/c16-11-5-4-8-13(9-11)20-10-14-17-18-15(21)19(14)12-6-2-1-3-7-12/h1-9H,10H2,(H,18,21)/p-1