3-[[4-fluoranyl-3-(trifluoromethyl)phenyl]methylsulfanyl]-4-[(4-fluorophenyl)methyl]-5-(trifluoromethyl)-1,2,4-triazole

Systemtic Name: 3-[[4-fluoranyl-3-(trifluoromethyl)phenyl]methylsulfanyl]-4-[(4-fluorophenyl)methyl]-5-(trifluoromethyl)-1,2,4-triazole Openeye Name: 4-[(4-fluorophenyl)methyl]-3-[[4-fluoro-3-(trifluoromethyl)phenyl]methylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazole CAS Name: 4-[(4-fluorophenyl)methyl]-3-[[4-fluoro-3-(trifluoromethyl)phenyl]methylthio]-5-(trifluoromethyl)-1,2,4-triazole IUPAC Name: 4-[(4-fluorophenyl)methyl]-3-[[4-fluoro-3-(trifluoromethyl)phenyl]methylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazole Traditional Name: 4-(4-fluorobenzyl)-3-[[4-fluoro-3-(trifluoromethyl)benzyl]thio]-5-(trifluoromethyl)-1,2,4-triazole Formula: C18H11F8N3S MolecularWeight: 453.352266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C(=NN=C2SCC3=CC(=C(C=C3)F)C(F)(F)F)C(F)(F)F)F

Isomeric SMILES

C1=CC(=CC=C1CN2C(=NN=C2SCC3=CC(=C(C=C3)F)C(F)(F)F)C(F)(F)F)F

InChI

InChI=1S/C18H11F8N3S/c19-12-4-1-10(2-5-12)8-29-15(18(24,25)26)27-28-16(29)30-9-11-3-6-14(20)13(7-11)17(21,22)23/h1-7H,8-9H2