2-[[4-(furan-2-ylmethyl)-5-[[[3-(trifluoromethyl)phenyl]amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-5-[[[3-(trifluoromethyl)phenyl]amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[4-(2-furylmethyl)-5-[[3-(trifluoromethyl)anilino]methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[4-(2-furanylmethyl)-5-[[3-(trifluoromethyl)anilino]methyl]-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[4-(furan-2-ylmethyl)-5-[[3-(trifluoromethyl)anilino]methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[4-(2-furfuryl)-5-[[3-(trifluoromethyl)anilino]methyl]-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C23H20F3N5O2S MolecularWeight: 487.49741

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)CNC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)CNC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C23H20F3N5O2S/c24-23(25,26)16-6-4-9-18(12-16)27-13-20-29-30-22(31(20)14-19-10-5-11-33-19)34-15-21(32)28-17-7-2-1-3-8-17/h1-12,27H,13-15H2,(H,28,32)