Hydrochloric Acid → HCID 25094622, compound

HRID 141414Notes

Reaction equation

HRID 141414 reaction equation
[CH2:17]([N:18]1[CH2:19][CH2:20][O:21][CH2:22][CH2:23]1)[CH3:24].[CH2:37]([N:38]=[C:39]=[N:40][CH2:41][CH2:42][CH2:43][N:44]([CH3:45])[CH3:46])[CH3:47].[CH3:1][N:2]1[C:3](=[O:16])[N:4]([c:10]2[n:11]([CH3:15])[cH:12][cH:13][n:14]2)[CH2:5][CH:6]1[C:7](=[O:8])[OH:9].[Cl:48][c:49]1[c:50]([CH2:59][NH2:60])[cH:51][cH:52][cH:53][c:54]1[C:55]([F:56])([F:57])[F:58].[Cl:61][CH2:62][Cl:63].[ClH:36].[OH2:25].[OH:26][n:27]1[c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]2[n:34][n:35]1>>[CH3:1][N:2]1[C:3](=[O:16])[N:4]([c:10]2[n:11]([CH3:15])[cH:12][cH:13][n:14]2)[CH2:5][CH:6]1[C:7](=[O:9])[NH:60][CH2:59][c:50]1[c:49]([Cl:48])[c:54]([C:55]([F:56])([F:57])[F:58])[cH:53][cH:52][cH:51]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 962WaterHCID 6344DichloromethaneHCID 7525EthylmorpholineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 52242072-Chloro-3-(trifluoromethyl)benzylamineHCID 671034053-methyl-1-(1-methyl-1H-imidazol-2-yl)-2-oxo-4-imidazolidinecarboxylic acid

Product 1

HCID 25094622HCID 25094622, compound

Sources & evidence

ORD record
ord-6a396c9de56544799fd90ad33c35d241
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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