Acetic Acid → 3-Amino-N-(4-bromo-phenyl)-4-(4-methanesulfonylamino-phenoxy)-benzamide

HRID 106523Notes

Reaction equation

HRID 106523 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9]([c:10]2[cH:11][c:12]([N+:28]([O-:29])=[O:30])[c:13]([O:16][c:17]3[cH:18][cH:19][c:20]([NH:23][S:24](=[O:25])(=[O:26])[CH3:27])[cH:21][cH:22]3)[cH:14][cH:15]2)=[O:31])[cH:6][cH:7]1.[CH3:38][C:39](=[O:40])[OH:41].[CH3:42][CH2:43][OH:44].[Fe:46].[Na+:32].[Na+:33].[O-:34][C:35](=[O:36])[O-:37].[OH2:45]>>[Br:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9]([c:10]2[cH:11][c:12]([NH2:28])[c:13]([O:16][c:17]3[cH:18][cH:19][c:20]([NH:23][S:24](=[O:25])(=[O:26])[CH3:27])[cH:21][cH:22]3)[cH:14][cH:15]2)=[O:31])[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 702EthanolHCID 923Sodium ion2×HCID 962WaterHCID 19660Carbonate IonHCID 23925IronHCID 67040270N-(4-Bromo-phenyl)-4-(4-methanesulfonylamino-phenoxy)-3-nitro-benzamide

Product 1

HCID 670406923-Amino-N-(4-bromo-phenyl)-4-(4-methanesulfonylamino-phenoxy)-benzamide

Sources & evidence

ORD record
ord-59b7c4449e2243359e8c6ce780cc93f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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