4-(4-fluorophenyl)-5-[oxidanyl(diphenyl)methyl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-fluorophenyl)-5-[oxidanyl(diphenyl)methyl]-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-fluorophenyl)-5-[hydroxy(diphenyl)methyl]-1,2,4-triazole-3-thiolate CAS Name: 4-(4-fluorophenyl)-5-[hydroxy(diphenyl)methyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-fluorophenyl)-5-[hydroxy(diphenyl)methyl]-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-fluorophenyl)-5-[hydroxy(diphenyl)methyl]-1,2,4-triazole-3-thiolate Formula: C21H15FN3OS- MolecularWeight: 376.426703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=NN=C(N3C4=CC=C(C=C4)F)[S-])O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=NN=C(N3C4=CC=C(C=C4)F)[S-])O

InChI

InChI=1S/C21H16FN3OS/c22-17-11-13-18(14-12-17)25-19(23-24-20(25)27)21(26,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14,26H,(H,24,27)/p-1