Hydrochloric Acid → N-(2-(5-chloro-1H-indol-3-yl)ethyl)-1-(3,5-difluorophenyl)-2-oxopyrrolidine-3-carboxamide

HRID 302024Notes

Reaction equation

HRID 302024 reaction equation
[CH:56]([N:57]([CH2:58][CH3:59])[CH:60]([CH3:61])[CH3:62])([CH3:63])[CH3:64].[Cl:2][c:3]1[cH:4][c:5]2[c:6]([CH2:12][CH2:13][NH2:14])[cH:7][nH:8][c:9]2[cH:10][cH:11]1.[ClH:1].[F:15][c:16]1[cH:17][c:18]([N:23]2[C:24](=[O:31])[CH:25]([C:28](=[O:29])[OH:30])[CH2:26][CH2:27]2)[cH:19][c:20]([F:22])[cH:21]1.[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[P-:32]([F:33])([F:34])([F:35])([F:36])([F:37])[F:38].[n:39]1([O:40][C:41]([N:42]([CH3:43])[CH3:44])=[N+:45]([CH3:46])[CH3:47])[c:48]2[n:49][cH:50][cH:51][cH:52][c:53]2[n:54][n:55]1>>[Cl:2][c:3]1[cH:4][c:5]2[c:6]([CH2:12][CH2:13][NH:14][C:28]([CH:25]3[C:24](=[O:31])[N:23]([c:18]4[cH:17][c:16]([F:15])[cH:21][c:20]([F:22])[cH:19]4)[CH2:27][CH2:26]3)=[O:29])[cH:7][nH:8][c:9]2[cH:10][cH:11]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 773795-ChlorotryptamineHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 246892091-(3,5-Difluorophenyl)-2-oxopyrrolidine-3-carboxylic acid

Product 1

HCID 66832038N-(2-(5-chloro-1H-indol-3-yl)ethyl)-1-(3,5-difluorophenyl)-2-oxopyrrolidine-3-carboxamide

Sources & evidence

ORD record
ord-c3573e20db19484cb16bffd68c12f7bb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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