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CHEBI:102025 - (2R,3S,4R)-1-(4,5-dimethyl-2-thiazolyl)-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile

ChEBI IDCHEBI:102025
ChEBI Name(2R,3S,4R)-1-(4,5-dimethyl-2-thiazolyl)-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile
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DownloadsMolfile
FormulaC16H17N3OS
Net Charge0
Average Mass299.399
Monoisotopic Mass299.10923
SMILESCc1nc(N2[C@@H](C#N)[C@H](c3ccccc3)[C@@H]2CO)sc1C
InChIInChI=1S/C16H17N3OS/c1-10-11(2)21-16(18-10)19-13(8-17)15(14(19)9-20)12-6-4-3-5-7-12/h3-7,13-15,20H,9H2,1-2H3/t13-,14-,15-/m0/s1
InChIKeyAVGQIEGBBUBHIP-KKUMJFAQSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3S,4R)-1-(4,5-dimethyl-2-thiazolyl)-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile (CHEBI:102025) is a azetidines (CHEBI:38777)
(2R,3S,4R)-1-(4,5-dimethyl-2-thiazolyl)-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile (CHEBI:102025) is a benzenes (CHEBI:22712)
(2R,3S,4R)-1-(4,5-dimethyl-2-thiazolyl)-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile (CHEBI:102025) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-13386LINCS