Hydrochloric Acid → HCID 66831936, compound

HRID 1135786Notes

Reaction equation

HRID 1135786 reaction equation
[CH:55]([N:56]([CH2:57][CH3:58])[CH:59]([CH3:60])[CH3:61])([CH3:62])[CH3:63].[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:64]=[CH:65][N:66]([CH3:67])[CH3:68].[OH:15][CH2:16][CH:17]([CH2:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[NH:25][C:26]([C:27](=[O:28])[OH:29])=[O:30].[P-:31]([F:32])([F:33])([F:34])([F:35])([F:36])[F:37].[n:38]1([O:39][C:40]([N:41]([CH3:42])[CH3:43])=[N+:44]([CH3:45])[CH3:46])[c:47]2[n:48][cH:49][cH:50][cH:51][c:52]2[n:53][n:54]1>>[Cl:2][c:3]1[cH:4][c:5]2[c:6]([CH2:12][CH2:13][NH:14][C:27]([C:26]([NH:25][CH:17]([CH2:16][OH:15])[CH2:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)=[O:30])=[O:28])[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 66831885HCID 66831885, compound

Product 1

HCID 66831936HCID 66831936, compound

Sources & evidence

ORD record
ord-0ccfe0e4b1454e4aae21e7fcd44ed24a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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