3-(5-tert-butyl-1H-pyrazol-3-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Formula: C16H16F3N5S MolecularWeight: 367.39195

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C2=NNC(=S)N2C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C2=NNC(=S)N2C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C16H16F3N5S/c1-15(2,3)12-8-10(20-21-12)13-22-23-14(25)24(13)11-7-5-4-6-9(11)16(17,18)19/h4-8H,1-3H3,(H,20,21)(H,23,25)