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

Systemtic Name: N-(4-methoxyphenyl)-2-[4-methyl-5-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl]sulfanyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: N-(4-methoxyphenyl)-2-[4-methyl-5-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanyl-1,2,4-triazol-3-yl]acetamide CAS Name: N-(4-methoxyphenyl)-2-[4-methyl-5-[[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]thio]-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(4-methoxyphenyl)-2-[4-methyl-5-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanyl-1,2,4-triazol-3-yl]acetamide Traditional Name: 2-[5-[[2-keto-2-[3-(trifluoromethyl)anilino]ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]-N-(4-methoxyphenyl)acetamide Formula: C21H20F3N5O3S MolecularWeight: 479.47541

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)CC(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)CC(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H20F3N5O3S/c1-29-17(11-18(30)25-14-6-8-16(32-2)9-7-14)27-28-20(29)33-12-19(31)26-15-5-3-4-13(10-15)21(22,23)24/h3-10H,11-12H2,1-2H3,(H,25,30)(H,26,31)