Hydrochloric Acid → 3-chloro-N-[1-(6-chloro-1H-benzimidazol-2-yl)ethyl]-4-pyrrolidin-1-ylsulfonylbenzamide

HRID 1126224Notes

Reaction equation

HRID 1126224 reaction equation
[B-:19]([F:20])([F:21])([F:22])[F:23].[CH3:64][N:65]([CH3:66])[CH:67]=[O:68].[CH3:69][CH2:70][O:71][C:72](=[O:73])[CH3:74].[CH:41]([N:42]([CH:43]([CH3:44])[CH3:45])[CH2:46][CH3:47])([CH3:48])[CH3:49].[Cl:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][c:10]1[S:11](=[O:12])(=[O:13])[N:14]1[CH2:15][CH2:16][CH2:17][CH2:18]1.[Cl:50][c:51]1[cH:52][cH:53][c:54]2[c:55]([nH:56][c:57]([CH:59]([CH3:60])[NH2:61])[n:58]2)[cH:62]1.[Cl:63].[n:24]1([O:25][C:26]([N:27]([CH3:28])[CH3:29])=[N+:30]([CH3:31])[CH3:32])[c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[Cl:1][c:2]1[cH:3][c:4]([C:5](=[O:7])[NH:61][CH:59]([c:57]2[nH:56][c:55]3[c:54]([cH:53][cH:52][c:51]([Cl:50])[cH:62]3)[n:58]2)[CH3:60])[cH:8][cH:9][c:10]1[S:11](=[O:12])(=[O:13])[N:14]1[CH2:15][CH2:16][CH2:17][CH2:18]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 26255TetrafluoroborateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 242525581-(5-chloro-1H-1,3-benzodiazol-2-yl)ethan-1-amineHCID 693111543-Chloro-4-(pyrrolidin-1-ylsulfonyl)benzoic acid

Product 1

HCID 723488713-chloro-N-[1-(6-chloro-1H-benzimidazol-2-yl)ethyl]-4-pyrrolidin-1-ylsulfonylbenzamide

Sources & evidence

ORD record
ord-5e7de553e2d445a399efcee65e91fced
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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