Concept information
...
nitrogen molecular entity
organonitrogen compound
organonitrogen heterocyclic compound
azetidines
...
organic cyclic compound
organic heterocyclic compound
organonitrogen heterocyclic compound
azetidines
...
organic cyclic compound
organic heterocyclic compound
organonitrogen heterocyclic compound
azetidines
...
organic cyclic compound
organic heterocyclic compound
organonitrogen heterocyclic compound
azetidines
...
organic cyclic compound
organic heterocyclic compound
organic heteromonocyclic compound
azetidines
Preferred term
(2s,3r,4s)-1-[2-(dimethylamino)-1-oxoethyl]-4-(hydroxymethyl)-3-[4-[2-(3-pyridinyl)ethynyl]phenyl]-2-azetidinecarbonitrile
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C22H22N4O2
inchi
- InChI=1S/C22H22N4O2/c1-25(2)14-21(28)26-19(12-23)22(20(26)15-27)18-9-7-16(8-10-18)5-6-17-4-3-11-24-13-17/h3-4,7-11,13,19-20,22,27H,14-15H2,1-2H3/t19-,20-,22-/m1/s1
inchikey
- VMSOXHKZIPRGST-KCZVDYSFSA-N
mass
- 374.437
monoisotopicmass
- 374.17428
smiles
- CN(C)CC(=O)N1[C@@H]([C@@H]([C@H]1C#N)C2=CC=C(C=C2)C#CC3=CN=CC=C3)CO
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:95383
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