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CHEBI:94231 - 2-[[5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-1-(4-phenyl-1-piperazinyl)ethanone

ChEBI IDCHEBI:94231
ChEBI Name2-[[5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-1-(4-phenyl-1-piperazinyl)ethanone
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FormulaC25H31N5O2S
Net Charge0
Average Mass465.623
Monoisotopic Mass465.21985
SMILESCCn1c(COc2c(C)cccc2C)nnc1SCC(=O)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C25H31N5O2S/c1-4-30-22(17-32-24-19(2)9-8-10-20(24)3)26-27-25(30)33-18-23(31)29-15-13-28(14-16-29)21-11-6-5-7-12-21/h5-12H,4,13-18H2,1-3H3
InChIKeyJNIASVBBJIIZMX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-1-(4-phenyl-1-piperazinyl)ethanone (CHEBI:94231) is a piperazines (CHEBI:26144)
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