Thiourea → HCID 87380363, compound

HRID 1126758Notes

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.[NH2:41][c:42]1[c:43]([CH3:57])[cH:44][c:45]([C:48](=[O:49])[N:50]2[CH2:51][CH2:52][N:53]([CH3:56])[CH2:54][CH2:55]2)[cH:46][cH:47]1.[NH2:58][C:59]([NH2:60])=[S:61]>>[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:59]([NH:41][c:42]3[c:43]([CH3:57])[cH:44][c:45]([C:48](=[O:49])[N:50]5[CH2:51][CH2:52][N:53]([CH3:56])[CH2:54][CH2:55]5)[cH:46][cH:47]3)=[S:61])[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

Reactant 3

HCID 2723790Thiourea

HCID 16665653HCID 16665653, compound

HCID 45258862Bis-(4-methoxybenzyl)-[5-(2-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)-pyrimidin-2-yl]-amine

Product 1

HCID 87380363HCID 87380363, compound

Sources & evidence

ORD record: ord-fb60880bd227424c9c1cf6823f6e66c7
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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