Hydrochloric Acid → HCID 21278855, compound

HRID 285149Notes

Reaction equation

HRID 285149 reaction equation
[Cl:12][c:13]1[cH:14][cH:15][c:16]2[c:17]([n:18]([CH2:22][C:23](=[O:24])[N:25]3[CH2:26][CH2:27][N:28]([NH2:31])[CH2:29][CH2:30]3)[c:19](=[O:21])[s:20]2)[cH:32]1.[ClH:11].[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[Cl:8])[cH:9][cH:10]1.[O:34]1[CH2:35][CH2:36][O:37][CH2:38][CH2:39]1.[OH2:33]>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[NH:31][N:28]2[CH2:27][CH2:26][N:25]([C:23]([CH2:22][n:18]3[c:17]4[c:16]([cH:15][cH:14][c:13]([Cl:12])[cH:32]4)[s:20][c:19]3=[O:21])=[O:24])[CH2:30][CH2:29]2)[cH:9][cH:10]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 962WaterHCID 312751,4-DioxaneHCID 678794-Fluorobenzoyl chlorideHCID 212788513-[2-(4-Aminopiperazin-1-yl)-2-oxoethyl]-5-chloro-1,3-benzothiazol-2(3H)-one

Product 1

HCID 21278855HCID 21278855, compound

Sources & evidence

ORD record
ord-d03f5fdde67d4e56b19938a8b9e4c369
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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