Carbonate Ion → Ethyl 6'-{[(ethylamino)carbonyl]amino}-4'-(4-phenyl-1,3-thiazol-2-yl)-3,3'-bipyridine-5-carboxylate

HRID 159072Notes

Reaction equation

HRID 159072 reaction equation
[Br:1][c:2]1[c:3](-[c:14]2[s:15][cH:16][c:17](-[c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[n:18]2)[cH:4][c:5]([NH:8][C:9](=[O:10])[NH:11][CH2:12][CH3:13])[n:6][cH:7]1.[C:45](=[O:46])([O-:47])[O-:48].[CH3:25][C:26]1([CH3:27])[C:28]([CH3:29])([CH3:30])[O:31][B:32]([c:33]2[cH:34][n:35][cH:36][c:37]([C:38](=[O:39])[O:40][CH2:41][CH3:42])[cH:43]2)[O:44]1.[Cs+:49].[Cs+:50]>>[c:2]1(-[c:33]2[cH:34][n:35][cH:36][c:37]([C:38](=[O:39])[O:40][CH2:41][CH3:42])[cH:43]2)[c:3](-[c:14]2[s:15][cH:16][c:17](-[c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[n:18]2)[cH:4][c:5]([NH:8][C:9](=[O:10])[NH:11][CH2:12][CH3:13])[n:6][cH:7]1

Participants

5

Reactant 4

HCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 3816953Ethyl 5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylateHCID 592085041-(5-Bromo-4-(4-phenylthiazol-2-yl)pyridin-2-yl)-3-ethylurea

Product 1

HCID 59208481Ethyl 6'-{[(ethylamino)carbonyl]amino}-4'-(4-phenyl-1,3-thiazol-2-yl)-3,3'-bipyridine-5-carboxylate

Sources & evidence

ORD record
ord-ad01be365c834a7e97d5551c468cd979
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…