Hydrochloric Acid → HCID 23150611, compound

HRID 700062Notes

Reaction equation

HRID 700062 reaction equation
[C:1](=[O:2])([OH:3])[C:4]12[CH2:5][CH2:6][C:7]([NH:12][CH2:13][C:14](=[O:15])[N:16]3[CH:17]([C:22]#[N:23])[CH2:18][CH:19]([F:21])[CH2:20]3)([CH2:8][CH2:9]1)[CH2:10][CH2:11]2.[CH3:35][N:36]([CH3:37])[CH2:38][CH2:39][CH2:40][N:41]=[C:42]=[N:43][CH2:44][CH3:45].[CH3:57][N:58]([c:59]1[cH:60][cH:61][cH:62][cH:63][n:64]1)[CH3:65].[CH3:66][N:67]([CH3:68])[CH:69]=[O:70].[ClH:34].[F:46][C:47]([c:48]1[cH:49][cH:50][c:51]([NH2:52])[cH:53][cH:54]1)([F:55])[F:56].[OH:24][n:25]1[c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]2[n:32][n:33]1>>[C:1](=[O:2])([C:4]12[CH2:5][CH2:6][C:7]([NH:12][CH2:13][C:14](=[O:15])[N:16]3[CH:17]([C:22]#[N:23])[CH2:18][CH:19]([F:21])[CH2:20]3)([CH2:8][CH2:9]1)[CH2:10][CH2:11]2)[NH:52][c:51]1[cH:50][cH:49][c:48]([C:47]([F:46])([F:55])[F:56])[cH:54][cH:53]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 99644-(Trifluoromethyl)anilineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 218852-DimethylaminopyridineHCID 757711-HydroxybenzotriazoleHCID 231496734-[[2-(2-Cyano-4-fluoropyrrolidin-1-yl)-2-oxoethyl]amino]bicyclo[2.2.2]octane-1-carboxylic acid

Product 1

HCID 23150611HCID 23150611, compound

Sources & evidence

ORD record
ord-d3203772d0ea41149af32a703bc51986
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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