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CHEBI:123253 - 3-[[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-(2-furanylmethyl)propanamide

ChEBI IDCHEBI:123253
ChEBI Name3-[[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-(2-furanylmethyl)propanamide
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DownloadsMolfile
FormulaC20H16F3N3O4S
Net Charge0
Average Mass451.426
Monoisotopic Mass451.08136
SMILESO=C(CCSc1nc(-c2ccc3c(c2)OCO3)cc(C(F)(F)F)n1)NCc1ccco1
InChIInChI=1S/C20H16F3N3O4S/c21-20(22,23)17-9-14(12-3-4-15-16(8-12)30-11-29-15)25-19(26-17)31-7-5-18(27)24-10-13-2-1-6-28-13/h1-4,6,8-9H,5,7,10-11H2,(H,24,27)
InChIKeyAVRLWTHPEGLUJT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-(2-furanylmethyl)propanamide (CHEBI:123253) is a benzodioxoles (CHEBI:38298)
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LSM-34695LINCS