Propargyl alcohol → [2-(3-Hexyl-phenyl)-5-(3-hydroxy-prop-1-ynyl)-3-methyl-3H-imidazol-4-yl]-(4-pyrrolidin-1-yl-piperidin-1-yl)-methanone

HRID 1127986Notes

Reaction equation

HRID 1127986 reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH3:6])[c:7]1[cH:8][c:9](-[c:13]2[n:14][c:15]([I:32])[c:16]([C:19](=[O:20])[N:21]3[CH2:22][CH2:23][CH:24]([N:27]4[CH2:28][CH2:29][CH2:30][CH2:31]4)[CH2:25][CH2:26]3)[n:17]2[CH3:18])[cH:10][cH:11][cH:12]1.[OH:33][CH2:34][C:35]#[CH:36]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH3:6])[c:7]1[cH:8][c:9](-[c:13]2[n:14][c:15]([C:36]#[C:35][CH2:34][OH:33])[c:16]([C:19](=[O:20])[N:21]3[CH2:22][CH2:23][CH:24]([N:27]4[CH2:28][CH2:29][CH2:30][CH2:31]4)[CH2:25][CH2:26]3)[n:17]2[CH3:18])[cH:10][cH:11][cH:12]1

Participants

3

Reactant 2

HCID 7859Propargyl alcoholHCID 57541122[2-(3-Hexyl-phenyl)-5-iodo-3-methyl-3H-imidazol-4-yl]-(4-pyrrolidin-1-yl-piperidin-1-yl)-methanone

Product 1

HCID 57541113[2-(3-Hexyl-phenyl)-5-(3-hydroxy-prop-1-ynyl)-3-methyl-3H-imidazol-4-yl]-(4-pyrrolidin-1-yl-piperidin-1-yl)-methanone

Sources & evidence

ORD record
ord-e883acd525db40f49b2ec8425b9dd425
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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