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CHEBI:98854 - 3-[4-[(2S,3R,4S)-2-cyano-1-[cyclopropyl(oxo)methyl]-4-(hydroxymethyl)-3-azetidinyl]phenyl]-N,N-dimethylbenzamide

ChEBI IDCHEBI:98854
ChEBI Name3-[4-[(2S,3R,4S)-2-cyano-1-[cyclopropyl(oxo)methyl]-4-(hydroxymethyl)-3-azetidinyl]phenyl]-N,N-dimethylbenzamide
Stars
DownloadsMolfile
FormulaC24H25N3O3
Net Charge0
Average Mass403.482
Monoisotopic Mass403.18959
SMILESCN(C)C(=O)c1cccc(-c2ccc([C@@H]3[C@@H](C#N)N(C(=O)C4CC4)[C@@H]3CO)cc2)c1
InChIInChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21-,22-/m1/s1
InChIKeyNDTMOTIIGWPVNE-YPAWHYETSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[4-[(2S,3R,4S)-2-cyano-1-[cyclopropyl(oxo)methyl]-4-(hydroxymethyl)-3-azetidinyl]phenyl]-N,N-dimethylbenzamide (CHEBI:98854) is a biphenyls (CHEBI:22888)
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