3-[2-oxidanylidene-2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-oxidanylidene-2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-oxo-2-[4-(trifluoromethyl)-1-piperidyl]ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-oxo-2-[4-(trifluoromethyl)-1-piperidinyl]ethyl]thio]-4-phenyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-oxo-2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-keto-2-[4-(trifluoromethyl)piperidino]ethyl]thio]-4-phenyl-1H-1,2,4-triazol-5-one Formula: C16H17F3N4O2S MolecularWeight: 386.39199

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(F)(F)F)C(=O)CSC2=NNC(=O)N2C3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(F)(F)F)C(=O)CSC2=NNC(=O)N2C3=CC=CC=C3

InChI

InChI=1S/C16H17F3N4O2S/c17-16(18,19)11-6-8-22(9-7-11)13(24)10-26-15-21-20-14(25)23(15)12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H,20,25)