Water → HCID 178510314, compound

HRID 184218Notes

Reaction equation

HRID 184218 reaction equation
[CH3:51][C:52]#[N:53].[N:1](=[N+:2]=[N-:3])[CH2:4][CH:5]1[CH2:6][N:7]([c:11]2[cH:12][c:13]([F:31])[c:14]([C:18]3=[CH:23][CH2:22][N:21]([CH2:24][c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[CH2:20][CH2:19]3)[c:15]([F:17])[cH:16]2)[C:8](=[O:10])[O:9]1.[OH2:54].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[NH2:1][CH2:4][CH:5]1[CH2:6][N:7]([c:11]2[cH:12][c:13]([F:31])[c:14]([C:18]3=[CH:23][CH2:22][N:21]([CH2:24][c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[CH2:20][CH2:19]3)[c:15]([F:17])[cH:16]2)[C:8](=[O:10])[O:9]1

Participants

5

Reactant 4

HCID 962WaterHCID 6342AcetonitrileHCID 11776TriphenylphosphineHCID 178514571HCID 178514571, compound

Product 1

HCID 178510314HCID 178510314, compound

Sources & evidence

ORD record
ord-b9729fa8e2474f939aeb7fc9e1e7c849
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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