Dimethylformamide → 2-Benzothiazol-2-ylmethylpiperidin-1-yl-[5-(4-fluorophenyl)-2-methylthiazol-4-yl]-methanone

HRID 2336039Notes

Reaction equation

HRID 2336039 reaction equation
[CH:41]([N:42]([CH:43]([CH3:44])[CH3:45])[CH2:46][CH3:47])([CH3:48])[CH3:49].[F:50][c:51]1[cH:52][cH:53][c:54](-[c:57]2[c:58]([C:63](=[O:64])[OH:65])[n:59][c:60]([CH3:62])[s:61]2)[cH:55][cH:56]1.[NH:1]1[CH:2]([CH2:7][c:8]2[s:9][c:10]3[c:11]([n:12]2)[cH:13][cH:14][cH:15][cH:16]3)[CH2:3][CH2:4][CH2:5][CH2:6]1.[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[P-:17]([F:18])([F:19])([F:20])([F:21])([F:22])[F:23].[n:24]1([O:25][C:26]([N:27]([CH3:28])[CH3:29])=[N+:30]([CH3:31])[CH3:32])[c:33]2[n:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[N:1]1([C:63]([c:58]2[c:57](-[c:54]3[cH:53][cH:52][c:51]([F:50])[cH:56][cH:55]3)[s:61][c:60]([CH3:62])[n:59]2)=[O:64])[CH:2]([CH2:7][c:8]2[s:9][c:10]3[c:11]([n:12]2)[cH:13][cH:14][cH:15][cH:16]3)[CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 223241255-(4-Fluorophenyl)-2-methyl-1,3-thiazole-4-carboxylic acidHCID 23146350HCID 23146350, compound

Product 1

HCID 231463432-Benzothiazol-2-ylmethylpiperidin-1-yl-[5-(4-fluorophenyl)-2-methylthiazol-4-yl]-methanone

Sources & evidence

ORD record
ord-f9997b160b4a438ca492309df1a88551
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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