Ethanol → HCID 68803345, compound

HRID 2317068Notes

Reaction equation

HRID 2317068 reaction equation
[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[CH3:49][CH2:50][OH:51].[N+:1]([c:2]1[cH:3][cH:4][c:5]([S:6]([O:7][c:14]2[n:15][c:16]([NH2:28])[n:17][c:18]3[c:23]2[CH2:22][CH2:21][CH:20]2[CH:19]3[CH2:27][CH2:26][CH2:25][CH2:24]2)(=[O:8])=[O:9])[cH:10][cH:11]1)([O-:12])=[O:13].[NH:29]1[CH2:30][CH:31]([N:33]([C:34]([O:35][C:36]([CH3:37])([CH3:38])[CH3:39])=[O:40])[CH3:41])[CH2:32]1>>[c:14]1([N:29]2[CH2:30][CH:31]([N:33]([C:34]([O:35][C:36]([CH3:37])([CH3:38])[CH3:39])=[O:40])[CH3:41])[CH2:32]2)[n:15][c:16]([NH2:28])[n:17][c:18]2[c:23]1[CH2:22][CH2:21][CH:20]1[CH:19]2[CH2:27][CH2:26][CH2:25][CH2:24]1

Participants

5

Reactant 4

HCID 702EthanolHCID 8471TriethylamineHCID 23033645tert-Butyl azetidin-3-yl(methyl)carbamateHCID 87580250HCID 87580250, compound

Product 1

HCID 68803345HCID 68803345, compound

Sources & evidence

ORD record
ord-42ab9f9395f14c11b98f832a9ffda3dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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