4-(3-chloranyl-4-fluoranyl-phenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(3-chloranyl-4-fluoranyl-phenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(3-chloro-4-fluoro-phenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(3-chloro-4-fluorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(3-chloro-4-fluorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(3-chloro-4-fluoro-phenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C15H10ClFN3OS- MolecularWeight: 334.775803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC(=C(C=C3)F)Cl)[S-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC(=C(C=C3)F)Cl)[S-]

InChI

InChI=1S/C15H11ClFN3OS/c1-21-11-5-2-9(3-6-11)14-18-19-15(22)20(14)10-4-7-13(17)12(16)8-10/h2-8H,1H3,(H,19,22)/p-1