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CHEBI:98825 - (2R,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-1-(4-phenyl-2-thiazolyl)-2-azetidinecarbonitrile

ChEBI IDCHEBI:98825
ChEBI Name(2R,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-1-(4-phenyl-2-thiazolyl)-2-azetidinecarbonitrile
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FormulaC25H23N3OS
Net Charge0
Average Mass413.546
Monoisotopic Mass413.15618
SMILESN#C[C@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1c1nc(-c2ccccc2)cs1
InChIInChI=1S/C25H23N3OS/c26-14-22-24(20-12-10-18(11-13-20)17-6-4-5-7-17)23(15-29)28(22)25-27-21(16-30-25)19-8-2-1-3-9-19/h1-3,6,8-13,16,22-24,29H,4-5,7,15H2/t22-,23+,24-/m0/s1
InChIKeyYWUOOJZCEOJKLU-VXNXHJTFSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-1-(4-phenyl-2-thiazolyl)-2-azetidinecarbonitrile (CHEBI:98825) is a azetidines (CHEBI:38777)
(2R,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-1-(4-phenyl-2-thiazolyl)-2-azetidinecarbonitrile (CHEBI:98825) is a benzenes (CHEBI:22712)
(2R,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-1-(4-phenyl-2-thiazolyl)-2-azetidinecarbonitrile (CHEBI:98825) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
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