Water → (2-Butyl-4-chloro-1-((2'-(1-trityl-1H-tetraazol-5-YL)(1,1'-biphenyl)-4-YL)methyl)-1H-imidazol-5-YL)methanol

HRID 1123194Notes

Reaction equation

HRID 1123194 reaction equation
[C:39]([c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1)([c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1)([c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1)[Cl:58].[CH2:2]([CH2:3][CH2:4][CH3:5])[c:6]1[n:7]([CH2:14][c:15]2[cH:16][cH:17][c:18](-[c:21]3[c:22](-[c:27]4[n:28][n:29][n:30][nH:31]4)[cH:23][cH:24][cH:25][cH:26]3)[cH:19][cH:20]2)[c:8]([CH2:12][OH:13])[c:9]([Cl:11])[n:10]1.[CH2:59]([Cl:60])[Cl:61].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[K:1].[OH2:62]>>[CH2:2]([CH2:3][CH2:4][CH3:5])[c:6]1[n:7]([CH2:14][c:15]2[cH:16][cH:17][c:18](-[c:21]3[c:22](-[c:27]4[n:28][n:29][n:30][n:31]4[C:39]([c:40]4[cH:41][cH:42][cH:43][cH:44][cH:45]4)([c:46]4[cH:47][cH:48][cH:49][cH:50][cH:51]4)[c:52]4[cH:53][cH:54][cH:55][cH:56][cH:57]4)[cH:23][cH:24][cH:25][cH:26]3)[cH:19][cH:20]2)[c:8]([CH2:12][OH:13])[c:9]([Cl:11])[n:10]1

Participants

7

Reactant 6

HCID 962WaterHCID 6344DichloromethaneHCID 6456Trityl chlorideHCID 8471TriethylamineHCID 5462222PotassiumHCID 178441684HCID 178441684, compound

Product 1

HCID 11643218(2-Butyl-4-chloro-1-((2'-(1-trityl-1H-tetraazol-5-YL)(1,1'-biphenyl)-4-YL)methyl)-1H-imidazol-5-YL)methanol

Sources & evidence

ORD record
ord-8cf9b9b7529e4b7e8039945ad1241c28
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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