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CHEBI:98094 - 3-(4-fluorophenyl)-1-[(2S)-1-hydroxypropan-2-yl]-1-[(2S,3S)-3-methoxy-2-methyl-4-[methyl-(1-methylimidazol-4-yl)sulfonylamino]butyl]urea

ChEBI IDCHEBI:98094
ChEBI Name3-(4-fluorophenyl)-1-[(2S)-1-hydroxypropan-2-yl]-1-[(2S,3S)-3-methoxy-2-methyl-4-[methyl-(1-methylimidazol-4-yl)sulfonylamino]butyl]urea
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FormulaC21H32FN5O5S
Net Charge0
Average Mass485.582
Monoisotopic Mass485.21082
SMILESCO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN(C(=O)Nc1ccc(F)cc1)[C@@H](C)CO
InChIInChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16-,19+/m0/s1
InChIKeyAPPCZAALLCDYNG-TXPKVOOTSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(4-fluorophenyl)-1-[(2S)-1-hydroxypropan-2-yl]-1-[(2S,3S)-3-methoxy-2-methyl-4-[methyl-(1-methylimidazol-4-yl)sulfonylamino]butyl]urea (CHEBI:98094) is a ureas (CHEBI:47857)
Manual XrefsDatabases
LSM-9473LINCS