Dimethylformamide → 1-(4-Chloro-3-trifluoromethylphenyl)-3-[2-(6,7-dimethoxyquinazolin-4-ylamino)benzothiazol-6-yl]urea

HRID 295864Notes

Reaction equation

HRID 295864 reaction equation
[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH3:15])[c:9]([O:12][CH3:13])[cH:10][c:11]12.[NH2:16][c:17]1[s:18][c:19]2[c:20]([n:21]1)[cH:22][cH:23][c:24]([NH:26][C:27](=[O:28])[NH:29][c:30]1[cH:31][c:32]([C:37]([F:38])([F:39])[F:40])[c:33]([Cl:36])[cH:34][cH:35]1)[cH:25]2.[O:41]1[CH2:42][CH2:43][O:44][CH2:45][CH2:46]1>>[c:2]1([NH:16][c:17]2[s:18][c:19]3[c:20]([n:21]2)[cH:22][cH:23][c:24]([NH:26][C:27](=[O:28])[NH:29][c:30]2[cH:31][c:32]([C:37]([F:38])([F:39])[F:40])[c:33]([Cl:36])[cH:34][cH:35]2)[cH:25]3)[n:3][cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH3:15])[c:9]([O:12][CH3:13])[cH:10][c:11]12

Participants

5

Reactant 4

HCID 6228DimethylformamideHCID 312751,4-DioxaneHCID 27693644-Chloro-6,7-dimethoxyquinazolineHCID 231325021-(2-Aminobenzothiazol-6-yl)-3-(4-chloro-3-trifluoromethylphenyl)urea

Product 1

HCID 231325001-(4-Chloro-3-trifluoromethylphenyl)-3-[2-(6,7-dimethoxyquinazolin-4-ylamino)benzothiazol-6-yl]urea

Sources & evidence

ORD record
ord-323b47f48403453bbd25d78fdaba0df4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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