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

Systemtic Name: 4-(cyclohexylmethyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(cyclohexylmethyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(cyclohexylmethyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(cyclohexylmethyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(cyclohexylmethyl)-3-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Formula: C16H18F3N3S MolecularWeight: 341.39443

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C(=NNC2=S)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)CN2C(=NNC2=S)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H18F3N3S/c17-16(18,19)13-8-6-12(7-9-13)14-20-21-15(23)22(14)10-11-4-2-1-3-5-11/h6-9,11H,1-5,10H2,(H,21,23)