Hydrochloric Acid → Hydrochloric Acid

HRID 675908Notes

Reaction equation

HRID 675908 reaction equation
[Br:17][CH2:18][CH2:19][C:20](=[O:21])[O:22][CH2:23][CH3:24].[CH3:25][C:26]#[N:27].[CH3:29][CH2:30][O:31][CH2:32][CH3:33].[CH3:34][CH2:35][O:36][C:37]([CH3:38])=[O:39].[ClH:28].[F:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([CH:9]3[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]3)[n:7][s:8]2)[cH:15][cH:16]1.[OH2:40]>>[ClH:28].[F:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([CH:9]3[CH2:10][CH2:11][N:12]([CH2:18][CH2:19][C:20](=[O:21])[O:22][CH2:23][CH3:24])[CH2:13][CH2:14]3)[n:7][s:8]2)[cH:15][cH:16]1

Participants

9

Reactant 7

HCID 313Hydrochloric AcidHCID 962WaterHCID 3283Diethyl EtherHCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 68320Ethyl 3-bromopropionateHCID 185049766-Fluoro-3-(4-piperidinyl)-1,2-benzisothiazole

Product 2

HCID 313Hydrochloric AcidHCID 18467249HCID 18467249, compound

Sources & evidence

ORD record
ord-eb915e19ab6945efa5268fb6e6c9c43b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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