2-[[4-(4-fluorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[4-(4-fluorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[[4-(4-fluorophenyl)-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]thiazole-4-carboxamide CAS Name: 2-[[[4-(4-fluorophenyl)-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]methyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-4-thiazolecarboxamide IUPAC Name: 2-[[4-(4-fluorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[[[4-(4-fluorophenyl)-5-(2-furyl)-1,2,4-triazol-3-yl]thio]methyl]-N-[3-(trifluoromethyl)benzyl]thiazole-4-carboxamide Formula: C25H17F4N5O2S2 MolecularWeight: 559.558393

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=CC=C(C=C4)F)C5=CC=CO5

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=CC=C(C=C4)F)C5=CC=CO5

InChI

InChI=1S/C25H17F4N5O2S2/c26-17-6-8-18(9-7-17)34-22(20-5-2-10-36-20)32-33-24(34)38-14-21-31-19(13-37-21)23(35)30-12-15-3-1-4-16(11-15)25(27,28)29/h1-11,13H,12,14H2,(H,30,35)