2-Aminothiazole → HCID 11950819, compound

HRID 2321598Notes

Reaction equation

HRID 2321598 reaction equation
[CH3:62][CH2:63][N:64]([CH2:65][CH3:66])[CH2:67][CH3:68].[F:1][c:2]1[c:3]([N:9]2[C:10](=[O:31])[NH:11][CH2:12][c:13]3[c:14]2[n:15][c:16]([S:29][CH3:30])[n:17][c:18]3-[c:19]2[cH:20][c:21]([C:22](=[O:23])[OH:24])[cH:25][cH:26][c:27]2[CH3:28])[c:4]([F:8])[cH:5][cH:6][cH:7]1.[NH2:32][c:33]1[s:34][cH:35][cH:36][n:37]1.[O:69]=[CH:70][N:71]([CH3:72])[CH3:73].[P-:38]([F:39])([F:40])([F:41])([F:42])([F:43])[F:44].[n:45]1([O:46][C:47]([N:48]([CH3:49])[CH3:50])=[N+:51]([CH3:52])[CH3:53])[c:54]2[cH:55][cH:56][cH:57][cH:58][c:59]2[n:60][n:61]1>>[F:1][c:2]1[c:3]([N:9]2[C:10](=[O:31])[NH:11][CH2:12][c:13]3[c:14]2[n:15][c:16]([S:29][CH3:30])[n:17][c:18]3-[c:19]2[cH:20][c:21]([C:22](=[O:23])[NH:32][c:33]3[s:34][cH:35][cH:36][n:37]3)[cH:25][cH:26][c:27]2[CH3:28])[c:4]([F:8])[cH:5][cH:6][cH:7]1

Participants

7

Reactant 6

HCID 21552-AminothiazoleHCID 6228DimethylformamideHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 119506223-[8-(2,6-Difluorophenyl)-2-(methylthio)-7-oxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]-4-methylbenzoic acid

Product 1

HCID 11950819HCID 11950819, compound

Sources & evidence

ORD record
ord-10c7d2c5c5cc4b2bb2a5a2e03559585a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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