Bicarbonate Ion → 2-[(1H-Imidazol-1-yl)(4-phenoxyphenyl)phenylmethyl]pyridine

HRID 2152294Notes

Reaction equation

HRID 2152294 reaction equation
[C:37](=[O:38])([OH:39])[O-:40].[CH2:42]([Cl:43])[Cl:44].[CH3:45][C:46]#[N:47].[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[Na+:41].[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([C:14]([OH:15])([c:16]2[n:17][cH:18][cH:19][cH:20][cH:21]2)[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[cH:12][cH:13]1.[OH2:54].[S:28]([Cl:29])([Cl:30])=[O:31].[nH:32]1[cH:33][n:34][cH:35][cH:36]1>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([C:14]([c:16]2[n:17][cH:18][cH:19][cH:20][cH:21]2)([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[n:32]2[cH:33][n:34][cH:35][cH:36]2)[cH:12][cH:13]1

Participants

10

Reactant 9

HCID 769Bicarbonate IonHCID 795ImidazoleHCID 923Sodium ionHCID 962WaterHCID 6342AcetonitrileHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 24386Thionyl ChlorideHCID 21330901HCID 21330901, compound

Product 1

HCID 213308992-[(1H-Imidazol-1-yl)(4-phenoxyphenyl)phenylmethyl]pyridine

Sources & evidence

ORD record
ord-47678aefc482449ca61f56aa1c874c51
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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