Aniline → 2-(5,6-Dimethoxy-benzoimidazol-1-yl)-4-phenyl-thiazole-5-carboxylic acid phenylamide

HRID 1213737Notes

Reaction equation

HRID 1213737 reaction equation
[CH2:28]([N:29]([CH2:30][CH3:31])[CH:32]([CH3:33])[CH3:34])[CH3:35].[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([n:7](-[c:10]3[s:11][c:12]([C:21](=[O:22])[OH:23])[c:13](-[c:15]4[cH:16][cH:17][cH:18][cH:19][cH:20]4)[n:14]3)[cH:8][n:9]2)[cH:24][c:25]1[O:26][CH3:27].[CH3:67][N:68]([CH3:69])[CH:70]=[O:71].[CH3:72][CH2:73][O:74][C:75](=[O:76])[CH3:77].[NH2:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[P-:36]([F:37])([F:38])([F:39])([F:40])([F:41])[F:42].[n:43]1([O:44][C:45]([N:46]([CH3:47])[CH3:48])=[N+:49]([CH3:50])[CH3:51])[c:52]2[n:53][cH:54][cH:55][cH:56][c:57]2[n:58][n:59]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([n:7](-[c:10]3[s:11][c:12]([C:21](=[O:23])[NH:60][c:61]4[cH:62][cH:63][cH:64][cH:65][cH:66]4)[c:13](-[c:15]4[cH:16][cH:17][cH:18][cH:19][cH:20]4)[n:14]3)[cH:8][n:9]2)[cH:24][c:25]1[O:26][CH3:27]

Participants

8

Reactant 7

HCID 6115AnilineHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 521913N,N-Diethyl-2-propanamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 236536592-(5,6-Dimethoxybenzoimidazol-1-yl)-4-phenylthiazole-5-carboxylic acid

Product 1

HCID 236544722-(5,6-Dimethoxy-benzoimidazol-1-yl)-4-phenyl-thiazole-5-carboxylic acid phenylamide

Sources & evidence

ORD record
ord-ee8374ebb1254910ac76ba2680e08b08
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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