Dimethyl Sulfoxide → 2-[(6-Amino-3-pyridinyl)methyl]-4-(4-morpholin-4-ylanilino)-1,1-dioxo-5-phenyl-1,2-thiazol-3-one

HRID 303976Notes

Reaction equation

HRID 303976 reaction equation
[CH3:43][S:44]([CH3:45])=[O:46].[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][cH:9][c:10]([NH:13][C:14]3=[C:18]([c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[S:17](=[O:25])(=[O:26])[N:16]([CH2:27][c:28]4[cH:29][cH:30][c:31]([NH:34][C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[n:32][cH:33]4)[C:15]3=[O:42])[cH:11][cH:12]2)[CH2:5][CH2:6]1>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][cH:9][c:10]([NH:13][C:14]3=[C:18]([c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[S:17](=[O:25])(=[O:26])[N:16]([CH2:27][c:28]4[cH:29][cH:30][c:31]([NH2:34])[n:32][cH:33]4)[C:15]3=[O:42])[cH:11][cH:12]2)[CH2:5][CH2:6]1

Participants

3

Reactant 2

HCID 679Dimethyl SulfoxideHCID 86623727tert-Butyl (5-{[4-[(4-morpholin-4-ylphenyl)amino]-1,1-dioxido-3-oxo-5-phenylisothiazol-2(3H)-yl]methyl}pyridin-2-yl)carbamate

Product 1

HCID 115404482-[(6-Amino-3-pyridinyl)methyl]-4-(4-morpholin-4-ylanilino)-1,1-dioxo-5-phenyl-1,2-thiazol-3-one

Sources & evidence

ORD record
ord-e230ed33fe35492cad0d51f2569d63b4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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