Hydrochloric Acid → Tert-butyl 1-[4-[5-[[2-phenyl-5-(trifluoromethyl)-1,3-oxazole-4-carbonyl]amino]-2-pyridinyl]benzoyl]pyrrolidine-2-carboxylate

HRID 2323824Notes

Reaction equation

HRID 2323824 reaction equation
[C:35]([CH3:36])([CH3:37])([CH3:38])[O:39][C:40]([CH:41]1[NH:42][CH2:43][CH2:44][CH2:45]1)=[O:46].[CH2:65]([N:66]=[C:67]=[N:68][CH2:69][CH2:70][CH2:71][N:72]([CH3:73])[CH3:74])[CH3:75].[CH3:47][CH2:48][N:49]([CH2:50][CH3:51])[CH2:52][CH3:53].[CH3:79][N:80]([CH3:81])[CH:82]=[O:83].[Cl:76][CH2:77][Cl:78].[ClH:34].[ClH:64].[OH:54][n:55]1[c:56]2[n:57][cH:58][cH:59][cH:60][c:61]2[n:62][n:63]1.[c:1]1(-[c:7]2[o:8][c:9]([C:30]([F:31])([F:32])[F:33])[c:10]([C:12](=[O:13])[NH:14][c:15]3[cH:16][cH:17][c:18](-[c:21]4[cH:22][cH:23][c:24]([C:25](=[O:26])[OH:27])[cH:28][cH:29]4)[n:19][cH:20]3)[n:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[o:8][c:9]([C:30]([F:31])([F:32])[F:33])[c:10]([C:12](=[O:13])[NH:14][c:15]3[cH:16][cH:17][c:18](-[c:21]4[cH:22][cH:23][c:24]([C:25](=[O:26])[N:42]5[CH:41]([C:40]([O:39][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:46])[CH2:45][CH2:44][CH2:43]5)[cH:28][cH:29]4)[n:19][cH:20]3)[n:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

9

Reactant 8

HCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 102884tert-butyl L-prolinateHCID 181649HOAtHCID 576519234-{5-[(2-Phenyl-5-trifluoromethyl-oxazole-4-carbonyl)-amino]-pyridin-2-yl}-benzoic acid

Product 1

HCID 66738325Tert-butyl 1-[4-[5-[[2-phenyl-5-(trifluoromethyl)-1,3-oxazole-4-carbonyl]amino]-2-pyridinyl]benzoyl]pyrrolidine-2-carboxylate

Sources & evidence

ORD record
ord-393c992e6d774dc1ad906c2fd01f3c0a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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