Isobutylamine → N-{2-Chloro-3-[5-{2-[(2-methylpropyl)amino]-4-pyrimidinyl}-2-(4-morpholinyl)-1,3-thiazol-4-yl]phenyl}-2,6-difluorobenzenesulfonamide

HRID 144297Notes

Reaction equation

HRID 144297 reaction equation
[CH2:38]([CH:39]([CH3:40])[CH3:41])[NH2:42].[Cl:1][c:2]1[c:3]([NH:26][S:27](=[O:28])(=[O:29])[c:30]2[c:31]([F:37])[cH:32][cH:33][cH:34][c:35]2[F:36])[cH:4][cH:5][cH:6][c:7]1-[c:8]1[n:9][c:10]([N:20]2[CH2:21][CH2:22][O:23][CH2:24][CH2:25]2)[s:11][c:12]1-[c:13]1[n:14][c:15]([Cl:19])[n:16][cH:17][cH:18]1>>[Cl:1][c:2]1[c:3]([NH:26][S:27](=[O:28])(=[O:29])[c:30]2[c:31]([F:37])[cH:32][cH:33][cH:34][c:35]2[F:36])[cH:4][cH:5][cH:6][c:7]1-[c:8]1[n:9][c:10]([N:20]2[CH2:21][CH2:22][O:23][CH2:24][CH2:25]2)[s:11][c:12]1-[c:13]1[n:14][c:15]([NH:42][CH2:38][CH:39]([CH3:40])[CH3:41])[n:16][cH:17][cH:18]1

Participants

3

Reactant 2

HCID 6558IsobutylamineHCID 57989885N-{2-Chloro-3-[5-(2-chloro-4-pyrimidinyl)-2-(4-morpholinyl)-1,3-thiazol-4-yl]phenyl}-2,6-difluorobenzenesulfonamide

Product 1

HCID 57990016N-{2-Chloro-3-[5-{2-[(2-methylpropyl)amino]-4-pyrimidinyl}-2-(4-morpholinyl)-1,3-thiazol-4-yl]phenyl}-2,6-difluorobenzenesulfonamide

Sources & evidence

ORD record
ord-ddd76d3e899b49318f062293be3de842
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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