Dimethyl Sulfoxide → tert-butyl 3-(3-(4-(1H-benzo[d]imidazole-2-carbonyl)phenoxy)pyrazin-2-yl)azetidine-1-carboxylate

HRID 139898Notes

Reaction equation

HRID 139898 reaction equation
[C:37](=[O:38])([O-:39])[O-:40].[CH3:43][S:44]([CH3:45])=[O:46].[Cl:1][c:2]1[c:3]([CH:8]2[CH2:9][N:10]([C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])[CH2:11]2)[n:4][cH:5][cH:6][n:7]1.[Cs+:41].[Cs+:42].[OH2:47].[nH:19]1[c:20]([C:28](=[O:29])[c:30]2[cH:31][cH:32][c:33]([OH:36])[cH:34][cH:35]2)[n:21][c:22]2[c:23]1[cH:24][cH:25][cH:26][cH:27]2>>[c:2]1([O:36][c:33]2[cH:32][cH:31][c:30]([C:28]([c:20]3[nH:19][c:23]4[c:22]([n:21]3)[cH:27][cH:26][cH:25][cH:24]4)=[O:29])[cH:35][cH:34]2)[c:3]([CH:8]2[CH2:9][N:10]([C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])[CH2:11]2)[n:4][cH:5][cH:6][n:7]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 59326874(1H-benzo[d]imidazol-2-yl)(4-hydroxyphenyl)methanoneHCID 59351411Tert-butyl 3-(3-chloropyrazin-2-yl)azetidine-1-carboxylate

Product 1

HCID 59327110tert-butyl 3-(3-(4-(1H-benzo[d]imidazole-2-carbonyl)phenoxy)pyrazin-2-yl)azetidine-1-carboxylate

Sources & evidence

ORD record
ord-ba94a93aa582413a80d26254d984f704
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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