Hydrochloric Acid → HCID 58349045, compound

HRID 99912

Reaction equation

HRID 99912 reaction equation
[CH2:38]([N:39]=[C:40]=[N:41][CH2:42][CH2:43][CH2:44][N:45]([CH3:46])[CH3:47])[CH3:48].[CH3:49][OH:50].[CH3:57][N:58]([CH3:59])[c:60]1[cH:61][cH:62][n:63][cH:64][cH:65]1.[ClH:37].[NH2:1][c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][cH:8][c:9]3[c:10]([nH:11][c:12]([NH:14][C:15](=[O:16])[CH:17]4[CH2:18][CH2:19]4)[n:13]3)[cH:20]2)[cH:21][cH:22][cH:23]1.[OH:24][C:25](=[O:26])[c:27]1[cH:28][cH:29][cH:30][c:31]([C:33]([F:34])([F:35])[F:36])[cH:32]1.[cH:51]1[cH:52][cH:53][n:54][cH:55][cH:56]1>>[NH:1]([c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][cH:8][c:9]3[c:10]([nH:11][c:12]([NH:14][C:15](=[O:16])[CH:17]4[CH2:18][CH2:19]4)[n:13]3)[cH:20]2)[cH:21][cH:22][cH:23]1)[C:25](=[O:24])[c:27]1[cH:28][cH:29][cH:30][c:31]([C:33]([F:34])([F:35])[F:36])[cH:32]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 887MethanolHCID 1049PyridineHCID 99633-(Trifluoromethyl)benzoic acidHCID 142844-(Dimethylamino)pyridineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 57388051HCID 57388051, compound

Product 1

HCID 58349045HCID 58349045, compound

Sources & evidence

ORD record
ord-49ca621b946d4d238dd1bd2f8a98c29f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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