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

Systemtic Name: 4-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-cyclopropyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-3-cyclopropyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-3-cyclopropyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-3-cyclopropyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-3-cyclopropyl-1H-1,2,4-triazole-5-thione Formula: C12H9ClF3N3S MolecularWeight: 319.73317

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NNC(=S)N2C3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C1CC1C2=NNC(=S)N2C3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C12H9ClF3N3S/c13-8-4-3-7(12(14,15)16)5-9(8)19-10(6-1-2-6)17-18-11(19)20/h3-6H,1-2H2,(H,18,20)