[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl] 4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)piperidine-1-carboxylate

Systemtic Name: [4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl] 4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)piperidine-1-carboxylate Openeye Name: [4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenyl] 4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)piperidine-1-carboxylate CAS Name: 4-[(1H-1,2,4-triazol-5-ylthio)methyl]-1-piperidinecarboxylic acid [4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl] ester IUPAC Name: [4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl] 4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)piperidine-1-carboxylate Traditional Name: 4-[(1H-1,2,4-triazol-5-ylthio)methyl]piperidine-1-carboxylic acid [4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenyl] ester Formula: C21H20F3N5O3S MolecularWeight: 479.47541

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CSC2=NC=NN2)C(=O)OC3=CC=C(C=C3)OC4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1CSC2=NC=NN2)C(=O)OC3=CC=C(C=C3)OC4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H20F3N5O3S/c22-21(23,24)15-1-6-18(25-11-15)31-16-2-4-17(5-3-16)32-20(30)29-9-7-14(8-10-29)12-33-19-26-13-27-28-19/h1-6,11,13-14H,7-10,12H2,(H,26,27,28)