Benzene → N-(4-chlorophenyl)-2-[((5-(bromomethyl)-3-chlorothiophen-2-yl)carbonyl)amino]-5-chlorobenzamide

HRID 687511Notes

Reaction equation

HRID 687511 reaction equation
[Br:28][N:29]1[C:30](=[O:31])[CH2:32][CH2:33][C:34]1=[O:35].[C:36]([O:37][O:38][C:39](=[O:40])[c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)(=[O:47])[c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9]([c:10]2[c:11]([NH:17][C:18](=[O:19])[c:20]3[s:21][c:22]([CH3:26])[cH:23][c:24]3[Cl:25])[cH:12][cH:13][c:14]([Cl:16])[cH:15]2)=[O:27])[cH:6][cH:7]1.[cH:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9]([c:10]2[c:11]([NH:17][C:18](=[O:19])[c:20]3[s:21][c:22]([CH2:26][Br:28])[cH:23][c:24]3[Cl:25])[cH:12][cH:13][c:14]([Cl:16])[cH:15]2)=[O:27])[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 7187Benzoyl PeroxideHCID 67184N-bromobutanimideHCID 183767483-chloro-N-{4-chloro-2-[(4-chlorophenyl)carbamoyl]phenyl}-5-methylthiophene-2-carboxamide

Product 1

HCID 18376771N-(4-chlorophenyl)-2-[((5-(bromomethyl)-3-chlorothiophen-2-yl)carbonyl)amino]-5-chlorobenzamide

Sources & evidence

ORD record
ord-af9f2c21d4cb4f99a6d5bcfb77c1348a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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