Hydrochloric Acid → 4-{2-[2-(Azetidin-1-ylmethyl)pyridin-4-yl]-4-chlorophenoxy}-2,5-difluoro-N-1,3-thiazol-4-ylbenzenesulfonamide

HRID 1115622Notes

Reaction equation

HRID 1115622 reaction equation
[CH2:48]1[O:49][CH2:50][CH2:51][O:52][CH2:53]1.[Cl:45][CH2:46][Cl:47].[ClH:44].[N:1]1([CH2:5][c:6]2[n:7][cH:8][cH:9][c:10](-[c:12]3[c:13]([O:14][c:15]4[cH:16][c:17]([F:38])[c:18]([S:22](=[O:23])(=[O:24])[N:25]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[c:33]5[n:34][cH:35][s:36][cH:37]5)[cH:19][c:20]4[F:21])[cH:39][cH:40][c:41]([Cl:43])[cH:42]3)[cH:11]2)[CH2:2][CH2:3][CH2:4]1>>[N:1]1([CH2:5][c:6]2[n:7][cH:8][cH:9][c:10](-[c:12]3[c:13]([O:14][c:15]4[cH:16][c:17]([F:38])[c:18]([S:22](=[O:23])(=[O:24])[NH:25][c:33]5[n:34][cH:35][s:36][cH:37]5)[cH:19][c:20]4[F:21])[cH:39][cH:40][c:41]([Cl:43])[cH:42]3)[cH:11]2)[CH2:2][CH2:3][CH2:4]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 312751,4-DioxaneHCID 59436494tert-Butyl [(4-{2-[2-(azetidin-1-ylmethyl)pyridin-4-yl]-4-chlorophenoxy}-2,5-difluorophenyl)sulfonyl]1,3-thiazol-4-ylcarbamate

Product 1

HCID 468419354-{2-[2-(Azetidin-1-ylmethyl)pyridin-4-yl]-4-chlorophenoxy}-2,5-difluoro-N-1,3-thiazol-4-ylbenzenesulfonamide

Sources & evidence

ORD record
ord-3c26f34bd0d64851817703a02f491a68
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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