Hydrochloric Acid → HCID 71134321, compound

HRID 169030Notes

Reaction equation

HRID 169030 reaction equation
[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[n:9]1[n:10][c:11]2[cH:12][c:13](-[c:18]3[cH:19][c:20](-[c:28]4[n:29][c:30]([CH:33]5[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]5)[s:31][cH:32]4)[n:21]4[n:22][cH:23][n:24][c:25]([NH2:27])[c:26]34)[cH:14][cH:15][c:16]2[cH:17]1.[CH3:39][N:40]([CH3:41])[CH2:42][C:43]([OH:44])=[O:45].[CH:56]([N:57]([CH2:58][CH3:59])[CH:60]([CH3:61])[CH3:62])([CH3:63])[CH3:64].[ClH:1].[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[OH:46][n:47]1[c:48]2[c:49]([cH:50][cH:51][cH:52][cH:53]2)[n:54][n:55]1>>[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[n:9]1[n:10][c:11]2[cH:12][c:13](-[c:18]3[cH:19][c:20](-[c:28]4[n:29][c:30]([CH:33]5[CH2:34][CH2:35][N:36]([C:43]([CH2:42][N:40]([CH3:39])[CH3:41])=[O:44])[CH2:37][CH2:38]5)[s:31][cH:32]4)[n:21]4[n:22][cH:23][n:24][c:25]([NH2:27])[c:26]34)[cH:14][cH:15][c:16]2[cH:17]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 673N,N-DimethylglycineHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 58529632HCID 58529632, compound

Product 1

HCID 71134321HCID 71134321, compound

Sources & evidence

ORD record
ord-347747cb9874453ea1e2f940447f880a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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