Hydrochloric Acid → HCID 67284875, compound

HRID 665286Notes

Reaction equation

HRID 665286 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][NH:17][c:18]1[n:19][c:20]([NH:30][c:31]2[cH:32][cH:33][c:34]([C:35](=[O:36])[OH:37])[cH:38][cH:39]2)[n:21][c:22]([O:24][CH2:25][C:26]([F:27])([F:28])[F:29])[n:23]1.[CH:70]([N:71]([CH2:72][CH3:73])[CH:74]([CH3:75])[CH3:76])([CH3:77])[CH3:78].[Cl:40][CH2:41][CH2:42][CH2:43][NH2:44].[ClH:45].[O:79]=[CH:80][N:81]([CH3:82])[CH3:83].[P-:46]([F:47])([F:48])([F:49])([F:50])([F:51])[F:52].[n:53]1([O:54][C:55]([N:56]([CH3:57])[CH3:58])=[N+:59]([CH3:60])[CH3:61])[c:62]2[n:63][cH:64][cH:65][cH:66][c:67]2[n:68][n:69]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][NH:17][c:18]1[n:19][c:20]([NH:30][c:31]2[cH:32][cH:33][c:34]([C:35](=[O:37])[NH:44][CH2:43][CH2:42][CH2:41][Cl:40])[cH:38][cH:39]2)[n:21][c:22]([O:24][CH2:25][C:26]([F:27])([F:28])[F:29])[n:23]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 846293-ChloropropylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 67285587HCID 67285587, compound

Product 1

HCID 67284875HCID 67284875, compound

Sources & evidence

ORD record
ord-dfbd4e04a47b4c80b411f64a9646145d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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