3-[2-(4-chlorophenyl)-2-oxidanyl-ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[2-(4-chlorophenyl)-2-oxidanyl-ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[2-(4-chlorophenyl)-2-hydroxy-ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-(4-chlorophenyl)-2-hydroxy-ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C16H14ClN3OS MolecularWeight: 331.81986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)CC(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)CC(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C16H14ClN3OS/c17-12-8-6-11(7-9-12)14(21)10-15-18-19-16(22)20(15)13-4-2-1-3-5-13/h1-9,14,21H,10H2,(H,19,22)