Acetate → HCID 86644055, compound

HRID 1143464Notes

Reaction equation

[C:48]([O-:49])(=[O:50])[CH3:51].[C:53]([O-:54])(=[O:55])[CH3:56].[CH3:57][c:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1.[N+:40](=[N-:41])=[CH:42][C:43](=[O:44])[O:45][CH2:46][CH3:47].[OH:1][CH:2]1[CH2:3][CH2:4][CH:5]([n:8]2[c:9]3[n:10]([c:11]([CH2:30][CH2:31][CH3:32])[c:12]([CH2:15][c:16]4[cH:17][cH:18][c:19](-[c:22]5[c:23]([C:28]#[N:29])[cH:24][cH:25][cH:26][cH:27]5)[cH:20][cH:21]4)[c:13]2=[O:14])[n:33][c:34]([C:36]([F:37])([F:38])[F:39])[n:35]3)[CH2:6][CH2:7]1.[Rh+2:52]>>[O:1]([CH:2]1[CH2:3][CH2:4][CH:5]([n:8]2[c:9]3[n:10]([c:11]([CH2:30][CH2:31][CH3:32])[c:12]([CH2:15][c:16]4[cH:17][cH:18][c:19](-[c:22]5[c:23]([C:28]#[N:29])[cH:24][cH:25][cH:26][cH:27]5)[cH:20][cH:21]4)[c:13]2=[O:14])[n:33][c:34]([C:36]([F:37])([F:38])[F:39])[n:35]3)[CH2:6][CH2:7]1)[CH2:42][C:43](=[O:44])[O:45][CH2:46][CH3:47]

Participants

Reactant 5

HCID 175Acetate2×

HCID 1140Toluene

HCID 12192Ethyl diazoacetate

HCID 185497Rhodium, ion(Rh2)

HCID 670101114'-{[4-(4-Hydroxycyclohexyl)-5-oxo-7-propyl-2-(trifluoromethyl)-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methyl}biphenyl-2-carbonitrile

Product 1

HCID 86644055HCID 86644055, compound

Sources & evidence

ORD record: ord-25bd898187974a10a1c728191a8e9751
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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