4-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide

Systemtic Name: 4-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Openeye Name: 4-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide CAS Name: 4-[[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]methyl]benzamide IUPAC Name: 4-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Traditional Name: 4-[[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]methyl]benzamide Formula: C12H11F3N4OS MolecularWeight: 316.30215

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=C(C=C2)C(=O)N)C(F)(F)F

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=C(C=C2)C(=O)N)C(F)(F)F

InChI

InChI=1S/C12H11F3N4OS/c1-19-10(12(13,14)15)17-18-11(19)21-6-7-2-4-8(5-3-7)9(16)20/h2-5H,6H2,1H3,(H2,16,20)