3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(3-chloranyl-4-fluoranyl-phenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(3-chloranyl-4-fluoranyl-phenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(3-chloro-4-fluoro-phenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(3-chloro-4-fluorophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(3-chloro-4-fluorophenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(3-chloro-4-fluoro-phenyl)-1H-1,2,4-triazole-5-thione Formula: C15H15ClFN5S MolecularWeight: 351.829503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C2=NNC(=S)N2C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C2=NNC(=S)N2C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C15H15ClFN5S/c1-15(2,3)12-7-11(18-19-12)13-20-21-14(23)22(13)8-4-5-10(17)9(16)6-8/h4-7H,1-3H3,(H,18,19)(H,21,23)