Hydrochloric Acid → HCID 24809796, compound

HRID 2147469Notes

Reaction equation

HRID 2147469 reaction equation
[CH2:16]([N:17]=[C:18]=[N:19][CH2:20][CH2:21][CH2:22][N:23]([CH3:24])[CH3:25])[CH3:26].[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH3:35][N:36]([C:37](=[O:38])[C:39]1([c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[CH2:40][NH:41][CH2:42][CH2:43]1)[CH3:50].[Cl:51][CH2:52][Cl:53].[ClH:15].[ClH:34].[c:1]1(-[c:7]2[c:8]([C:12](=[O:13])[OH:14])[cH:9][n:10][o:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[c:8]([C:12](=[O:14])[N:41]3[CH2:40][C:39]([C:37]([N:36]([CH3:35])[CH3:50])=[O:38])([c:44]4[cH:45][cH:46][cH:47][cH:48][cH:49]4)[CH2:43][CH2:42]3)[cH:9][n:10][o:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 313Hydrochloric Acid2×HCID 6344DichloromethaneHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 147872535-Phenylisoxazole-4-carboxylic acidHCID 68685779N,N-dimethyl-3-phenylpyrrolidine-3-carboxamide

Product 1

HCID 24809796HCID 24809796, compound

Sources & evidence

ORD record
ord-a9eee8e835df44db92d1f258a18e75b7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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