4-[4-chloranyl-2-(trifluoromethyl)phenyl]-3-propyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[4-chloranyl-2-(trifluoromethyl)phenyl]-3-propyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[4-chloro-2-(trifluoromethyl)phenyl]-3-propyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[4-chloro-2-(trifluoromethyl)phenyl]-3-propyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[4-chloro-2-(trifluoromethyl)phenyl]-3-propyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[4-chloro-2-(trifluoromethyl)phenyl]-3-propyl-1H-1,2,4-triazole-5-thione Formula: C12H11ClF3N3S MolecularWeight: 321.74905

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1C2=C(C=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CCCC1=NNC(=S)N1C2=C(C=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C12H11ClF3N3S/c1-2-3-10-17-18-11(20)19(10)9-5-4-7(13)6-8(9)12(14,15)16/h4-6H,2-3H2,1H3,(H,18,20)