2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide

Systemtic Name: 2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide Openeye Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide CAS Name: 2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-(2,2,2-trifluoroethyl)acetamide IUPAC Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide Traditional Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-(2,2,2-trifluoroethyl)acetamide Formula: C14H15F3N4OS MolecularWeight: 344.35531

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NCC(F)(F)F)CC2=CC=CC=C2

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NCC(F)(F)F)CC2=CC=CC=C2

InChI

InChI=1S/C14H15F3N4OS/c1-21-11(7-10-5-3-2-4-6-10)19-20-13(21)23-8-12(22)18-9-14(15,16)17/h2-6H,7-9H2,1H3,(H,18,22)