Dimethylformamide → N-{dicyclopropyl[5-(3-methyl-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)-1,3-thiazol-2-yl]methyl}cyclopropane-1,1-dicarboxamide

HRID 304243Notes

Reaction equation

HRID 304243 reaction equation
[C:1]([NH2:2])(=[O:3])[C:4]1([C:7](=[O:8])[OH:9])[CH2:5][CH2:6]1.[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[CH:41]([N:42]([CH2:43][CH3:44])[CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[NH2:10][C:11]([c:12]1[s:13][c:14](-[c:17]2[cH:18][c:19]([NH:24][c:25]3[n:26][cH:27][cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[n:30]3)[cH:20][c:21]([CH3:23])[cH:22]2)[cH:15][n:16]1)([CH:35]1[CH2:36][CH2:37]1)[CH:38]1[CH2:39][CH2:40]1.[O:50]=[CH:51][N:52]([CH3:53])[CH3:54]>>[C:1]([NH2:2])(=[O:3])[C:4]1([C:7](=[O:9])[NH:10][C:11]([c:12]2[s:13][c:14](-[c:17]3[cH:18][c:19]([NH:24][c:25]4[n:26][cH:27][cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[n:30]4)[cH:20][c:21]([CH3:23])[cH:22]3)[cH:15][n:16]2)([CH:35]2[CH2:36][CH2:37]2)[CH:38]2[CH2:39][CH2:40]2)[CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 81531DiisopropylethylamineHCID 27332721-(Aminocarbonyl)-1-cyclopropanecarboxylic acidHCID 58456217N-(3-{2-[amino(dicyclopropyl)methyl]-1,3-thiazol-5-yl}-5-methylphenyl)-4-(trifluoromethyl)-pyrimidin-2-amine

Product 1

HCID 67433438N-{dicyclopropyl[5-(3-methyl-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)-1,3-thiazol-2-yl]methyl}cyclopropane-1,1-dicarboxamide

Sources & evidence

ORD record
ord-6343a540bca240ef8417a9f53c35bfb9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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