Hydrochloric Acid → HCID 49868777, compound

HRID 155194Notes

Reaction equation

HRID 155194 reaction equation
[CH2:15]([CH3:16])[O:17][CH2:18][CH:19]1[CH2:20][C:21]([C:24](=[O:25])[OH:26])=[N:22][O:23]1.[CH:51]([N:52]([CH2:53][CH3:54])[CH:55]([CH3:56])[CH3:57])([CH3:58])[CH3:59].[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].[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[P-:27]([F:28])([F:29])([F:30])([F:31])([F:32])[F:33].[n:34]1([O:35][C:36]([N:37]([CH3:38])[CH3:39])=[N+:40]([CH3:41])[CH3:42])[c:43]2[n:44][cH:45][cH:46][cH:47][c:48]2[n:49][n:50]1>>[Cl:2][c:3]1[cH:4][c:5]2[c:6]([CH2:12][CH2:13][NH:14][C:24]([C:21]3=[N:22][O:23][CH:19]([CH2:18][O:17][CH2:15][CH3:16])[CH2:20]3)=[O:25])[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 668317425-(Ethoxymethyl)-4,5-dihydroisoxazole-3-carboxylic acid

Product 1

HCID 49868777HCID 49868777, compound

Sources & evidence

ORD record
ord-3d21527ab46b44b596ad77d547d7f233
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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