Benzyl isocyanate → N-{4-[5-(4-Aminothieno[2,3-d]pyrimidin-6-yl)-1-methyl-1H-imidazol-4-yl]phenyl}-N'-benzylurea

HRID 2348931Notes

Reaction equation

HRID 2348931 reaction equation
[CH2:47]([c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)[N:54]=[C:55]=[O:56].[NH2:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][cH:10][n:11]([CH3:23])[c:12]2-[c:13]2[cH:14][c:15]3[c:16]([n:17][cH:18][n:19][c:20]3[NH2:21])[s:22]2)[cH:6][cH:7]1.[NH2:24][c:25]1[cH:26][c:27](-[c:28]2[n:29][cH:30][n:31]([CH3:32])[c:33]2-[c:34]2[s:35][c:36]3[n:37][cH:38][n:39][c:40]([NH2:41])[c:42]3[cH:43]2)[cH:44][cH:45][cH:46]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][cH:10][n:11]([CH3:23])[c:12]2-[c:13]2[cH:14][c:15]3[c:16]([n:17][cH:18][n:19][c:20]3[NH2:21])[s:22]2)[cH:6][cH:7]1)[C:55]([NH:54][CH2:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)=[O:56]

Participants

4

Reactant 3

HCID 76639Benzyl isocyanateHCID 690543996-[4-(3-aminophenyl)-1-methyl-1H-imidazol-5-yl]thieno[2,3-d]pyrimidin-4-amineHCID 691971586-[4-(4-Aminophenyl)-1-methyl-1H-imidazol-5-yl]thieno[2,3-d]pyrimidin-4-amine

Product 1

HCID 10027041N-{4-[5-(4-Aminothieno[2,3-d]pyrimidin-6-yl)-1-methyl-1H-imidazol-4-yl]phenyl}-N'-benzylurea

Sources & evidence

ORD record
ord-26dcd4a206174646a2cf850ced9b7aad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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