Diisopropylamine → 3-[5-(2-Ethylbenzoimidazol-1-yl)-7-morpholin-4-ylthiazolo[5,4-d]pyrimidin-2-ylmethylene]azetidine-1-carboxylic acid tert-butyl ester

HRID 692873Notes

Reaction equation

HRID 692873 reaction equation
[C:46]([CH3:47])([CH3:48])([CH3:49])[O:50][C:51](=[O:52])[N:53]1[CH2:54][C:55](=[O:57])[CH2:56]1.[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[CH3:13][O:14][P:15](=[O:16])([O:17][CH3:18])[CH2:19][c:20]1[s:21][c:22]2[n:23][c:24](-[n:35]3[c:36]([CH2:44][CH3:45])[n:37][c:38]4[c:39]3[cH:40][cH:41][cH:42][cH:43]4)[n:25][c:26]([N:29]3[CH2:30][CH2:31][O:32][CH2:33][CH2:34]3)[c:27]2[n:28]1.[CH3:8][CH2:9][CH2:10][CH2:11][Li:12].[CH:1]([NH:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7]>>[CH:19]([c:20]1[s:21][c:22]2[n:23][c:24](-[n:35]3[c:36]([CH2:44][CH3:45])[n:37][c:38]4[c:39]3[cH:40][cH:41][cH:42][cH:43]4)[n:25][c:26]([N:29]3[CH2:30][CH2:31][O:32][CH2:33][CH2:34]3)[c:27]2[n:28]1)=[C:55]1[CH2:54][N:53]([C:51]([O:50][C:46]([CH3:47])([CH3:48])[CH3:49])=[O:52])[CH2:56]1

Participants

6

Reactant 5

HCID 7912DiisopropylamineHCID 8028TetrahydrofuranHCID 15194043-Oxo-azetidine-1-carboxylic acid tert-butyl esterHCID 59606043[5-(2-Ethylbenzoimidazol-1-yl)-7-morpholin-4-ylthiazolo[5,4-d]pyrimidin-2-ylmethyl]phosphonic acid dimethyl esterHCID 178418339Butyllithium

Product 1

HCID 596056233-[5-(2-Ethylbenzoimidazol-1-yl)-7-morpholin-4-ylthiazolo[5,4-d]pyrimidin-2-ylmethylene]azetidine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-591a43a623ee428f8a7e051eb90fb5e9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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