Water → HCID 42626054, compound

HRID 1234371Notes

Reaction equation

HRID 1234371 reaction equation
[C:25]([CH3:26])([CH3:27])([CH3:28])[O:29][C:30]([NH:31][c:32]1[c:33]([NH2:38])[cH:34][cH:35][cH:36][cH:37]1)=[O:39].[CH3:40][O:41][C:42](=[O:43])[c:44]1[cH:45][cH:46][c:47]([C:50](=[O:51])[OH:52])[n:48][cH:49]1.[CH3:53][N:54]1[CH2:55][CH2:56][O:57][CH2:58][CH2:59]1.[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[OH2:65].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[C:25]([CH3:26])([CH3:27])([CH3:28])[O:29][C:30]([NH:31][c:32]1[c:33]([NH:38][C:50]([c:47]2[cH:46][cH:45][c:44]([C:42]([O:41][CH3:40])=[O:43])[cH:49][n:48]2)=[O:51])[cH:34][cH:35][cH:36][cH:37]1)=[O:39]

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 79724-MethylmorpholineHCID 9886HexafluorophosphateHCID 3149925-(Methoxycarbonyl)pyridine-2-carboxylic acidHCID 676311N-(tert-Butoxycarbonyl)-1,2-phenylenediamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 42626054HCID 42626054, compound

Sources & evidence

ORD record
ord-5332087a40074dd2b8b6e27dc10cc6a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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