Urea → HCID 67385222, compound

HRID 208873Notes

Reaction equation

HRID 208873 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][cH:11][c:12](-[c:15]3[c:16]4[c:17]([n:18][c:19]([N:21]5[CH2:22][CH2:23][O:24][CH2:25][CH2:26]5)[n:20]3)[NH:27][CH2:28][CH2:29]4)[cH:13][n:14]2)[CH2:30][c:31]2[cH:32][cH:33][c:34]([O:37][CH3:38])[cH:35][cH:36]2)[cH:39][cH:40]1.[N:41](=[C:42]=[O:43])[c:44]1[c:45]([CH3:50])[n:46][cH:47][cH:48][cH:49]1.[NH2:51][C:52](=[O:53])[NH2:54]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][cH:11][c:12](-[c:15]3[c:16]4[c:17]([n:18][c:19]([N:21]5[CH2:22][CH2:23][O:24][CH2:25][CH2:26]5)[n:20]3)[N:27]([C:42]([NH:41][c:44]3[c:45]([CH3:50])[n:46][cH:47][cH:48][cH:49]3)=[O:43])[CH2:28][CH2:29]4)[cH:13][n:14]2)[CH2:30][c:31]2[cH:32][cH:33][c:34]([O:37][CH3:38])[cH:35][cH:36]2)[cH:39][cH:40]1

Participants

4

Reactant 3

HCID 1176UreaHCID 45258862Bis-(4-methoxybenzyl)-[5-(2-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)-pyrimidin-2-yl]-amineHCID 569726683-Isocyanato-2-methylpyridine

Product 1

HCID 67385222HCID 67385222, compound

Sources & evidence

ORD record
ord-8f55fed0f9e9467cbc5f294ffd3fa334
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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