2-Aminothiazole → 3-(1-(4-fluorophenyl)-1H-indazol-5-yl)-2,2-dimethyl-4-phenyl-N-(thiazol-2-yl)butanamide

HRID 1148864Notes

Reaction equation

HRID 1148864 reaction equation
[CH:31]([N:32]([CH:33]([CH3:34])[CH3:35])[CH2:36][CH3:37])([CH3:38])[CH3:39].[F:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][c:11]3[cH:12][c:13]([CH:17]([C:18]([C:19](=[O:20])[OH:21])([CH3:22])[CH3:23])[CH2:24][c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[cH:14][cH:15][c:16]23)[cH:6][cH:7]1.[NH2:64][c:65]1[s:66][cH:67][cH:68][n:69]1.[O:70]=[CH:71][N:72]([CH3:73])[CH3:74].[P-:40]([F:41])([F:42])([F:43])([F:44])([F:45])[F:46].[n:47]1([O:48][C:49]([N:50]([CH3:51])[CH3:52])=[N+:53]([CH3:54])[CH3:55])[c:56]2[n:57][cH:58][cH:59][cH:60][c:61]2[n:62][n:63]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][c:11]3[cH:12][c:13]([CH:17]([C:18]([C:19](=[O:21])[NH:64][c:65]4[s:66][cH:67][cH:68][n:69]4)([CH3:22])[CH3:23])[CH2:24][c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[cH:14][cH:15][c:16]23)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 21552-AminothiazoleHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 670060253-(1-(4-fluorophenyl)-1H-indazol-5-yl)-2,2-dimethyl-4-phenylbutanoic acid

Product 1

HCID 592528103-(1-(4-fluorophenyl)-1H-indazol-5-yl)-2,2-dimethyl-4-phenyl-N-(thiazol-2-yl)butanamide

Sources & evidence

ORD record
ord-32ae09f1029a42b3a854c4dadce62176
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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