Hydrochloric Acid → Hydrochloric Acid

HRID 1238018Notes

Reaction equation

HRID 1238018 reaction equation
[CH3:39][C:40](=[O:41])[O:42][C:43](=[O:44])[CH3:45].[CH3:52][N:53]([c:54]1[cH:55][cH:56][n:57][cH:58][cH:59]1)[CH3:60].[ClH:1].[ClH:2].[NH2:3][c:4]1[c:5]([CH3:38])[cH:6][c:7]([O:8][c:9]2[cH:10][cH:11][c:12]3[c:13]([n:14]([CH3:33])[c:15]([CH2:17][O:18][c:19]4[cH:20][cH:21][c:22]([CH2:23][CH:24]5[C:25](=[O:30])[NH:26][C:27](=[O:29])[S:28]5)[cH:31][cH:32]4)[n:16]3)[cH:34]2)[cH:35][c:36]1[CH3:37].[O:61]1[CH2:62][CH2:63][CH2:64][CH2:65]1.[cH:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1>>[ClH:1].[NH:3]([c:4]1[c:5]([CH3:38])[cH:6][c:7]([O:8][c:9]2[cH:10][cH:11][c:12]3[c:13]([n:14]([CH3:33])[c:15]([CH2:17][O:18][c:19]4[cH:20][cH:21][c:22]([CH2:23][CH:24]5[C:25](=[O:30])[NH:26][C:27](=[O:29])[S:28]5)[cH:31][cH:32]4)[n:16]3)[cH:34]2)[cH:35][c:36]1[CH3:37])[C:40]([CH3:39])=[O:41]

Participants

8

Reactant 6

HCID 313Hydrochloric Acid2×HCID 1049PyridineHCID 7918Acetic AnhydrideHCID 8028TetrahydrofuranHCID 142844-(Dimethylamino)pyridineHCID 9832447Efatutazone

Product 2

HCID 313Hydrochloric AcidHCID 77844522N-[4-[2-[[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenoxy]methyl]-3-methylbenzimidazol-5-yl]oxy-2,6-dimethylphenyl]acetamide

Sources & evidence

ORD record
ord-6ce3861db52e4a42ab5c5b66e3bce972
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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