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CHEBI:101199 - 1-[(2S,3R)-4-[(4-chlorophenyl)sulfonyl-methylamino]-3-methoxy-2-methylbutyl]-3-(2-fluorophenyl)-1-[(2R)-1-hydroxypropan-2-yl]urea

ChEBI IDCHEBI:101199
ChEBI Name1-[(2S,3R)-4-[(4-chlorophenyl)sulfonyl-methylamino]-3-methoxy-2-methylbutyl]-3-(2-fluorophenyl)-1-[(2R)-1-hydroxypropan-2-yl]urea
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DownloadsMolfile
FormulaC23H31ClFN3O5S
Net Charge0
Average Mass516.035
Monoisotopic Mass515.16570
SMILESCO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN(C(=O)Nc1ccccc1F)[C@H](C)CO
InChIInChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m0/s1
InChIKeyPIYRLUCWZXVSBU-JKSBSHDWSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(2S,3R)-4-[(4-chlorophenyl)sulfonyl-methylamino]-3-methoxy-2-methylbutyl]-3-(2-fluorophenyl)-1-[(2R)-1-hydroxypropan-2-yl]urea (CHEBI:101199) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-12568LINCS