Acetonitrile → (9-(3-(2-Hydroxyethyl)benzyl)-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)(4-isopropylthiazol-2-yl)methanone

HRID 288224Notes

Reaction equation

HRID 288224 reaction equation
[Br:22][CH2:23][c:24]1[cH:25][c:26]([CH2:30][CH2:31][OH:32])[cH:27][cH:28][cH:29]1.[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:40][C:41]#[N:42].[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][c:6]([C:9](=[O:10])[N:11]2[CH2:12][CH2:13][O:14][C:15]3([CH2:16]2)[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]3)[s:7][cH:8]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][c:6]([C:9](=[O:10])[N:11]2[CH2:12][CH2:13][O:14][C:15]3([CH2:16]2)[CH2:17][CH2:18][N:19]([CH2:23][c:24]2[cH:25][c:26]([CH2:30][CH2:31][OH:32])[cH:27][cH:28][cH:29]2)[CH2:20][CH2:21]3)[s:7][cH:8]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 18999576Benzeneethanol, 3-(bromomethyl)-HCID 57989334(4-Isopropylthiazol-2-yl)(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone

Product 1

HCID 57988911(9-(3-(2-Hydroxyethyl)benzyl)-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)(4-isopropylthiazol-2-yl)methanone

Sources & evidence

ORD record
ord-8a61488d6096484ebea67b0ea4ec7c3c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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