2-[[4-azanyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-dimethyl-2-phenyl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-dimethyl-2-phenyl-ethanamide Openeye Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-dimethyl-2-phenyl-acetamide CAS Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-N,N-dimethyl-2-phenylacetamide IUPAC Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-dimethyl-2-phenylacetamide Traditional Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-N,N-dimethyl-2-phenyl-acetamide Formula: C13H14F3N5OS MolecularWeight: 345.34337

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1=CC=CC=C1)SC2=NN=C(N2N)C(F)(F)F

Isomeric SMILES

CN(C)C(=O)C(C1=CC=CC=C1)SC2=NN=C(N2N)C(F)(F)F

InChI

InChI=1S/C13H14F3N5OS/c1-20(2)10(22)9(8-6-4-3-5-7-8)23-12-19-18-11(21(12)17)13(14,15)16/h3-7,9H,17H2,1-2H3