Hydrochloric Acid → 1,1-Dioxido-2-(4-(4-(5-tert-butyl-2-oxo-3-benzoxazolinyl)-piperidin-1-yl)-butyl)-1,2-benzisothiazol-3(2H)-one

HRID 104990Notes

Reaction equation

HRID 104990 reaction equation
[Br:22][CH2:23][CH2:24][CH2:25][CH2:26][N:27]1[S:28](=[O:37])(=[O:38])[c:29]2[c:30]([cH:33][cH:34][cH:35][cH:36]2)[C:31]1=[O:32].[C:2]([CH3:3])([CH3:4])([CH3:5])[c:6]1[cH:7][cH:8][c:9]2[c:10]([n:11]([CH:15]3[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]3)[c:12](=[O:14])[o:13]2)[cH:21]1.[ClH:1]>>[C:2]([CH3:3])([CH3:4])([CH3:5])[c:6]1[cH:7][cH:8][c:9]2[c:10]([n:11]([CH:15]3[CH2:16][CH2:17][N:18]([CH2:23][CH2:24][CH2:25][CH2:26][N:27]4[S:28](=[O:37])(=[O:38])[c:29]5[c:30]([cH:33][cH:34][cH:35][cH:36]5)[C:31]4=[O:32])[CH2:19][CH2:20]3)[c:12](=[O:14])[o:13]2)[cH:21]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 107817741,1-Dioxido-2-(4-bromobutyl)-1,2-benzisothiazol-3(2H)-oneHCID 190858974-(5-Tert-butyl-2-oxo-3-benzoxazolinyl)-piperidine

Product 1

HCID 190858521,1-Dioxido-2-(4-(4-(5-tert-butyl-2-oxo-3-benzoxazolinyl)-piperidin-1-yl)-butyl)-1,2-benzisothiazol-3(2H)-one

Sources & evidence

ORD record
ord-4ba5111ea4694e96a42fb11a21ca562b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…