Dimethylformamide → 2-(2,6-dichlorophenyl)-1H-indole-6-carboxylic acid (3,4-dimethylphenyl)-amide

HRID 1536186Notes

Reaction equation

HRID 1536186 reaction equation
[CH3:21][c:22]1[cH:23][cH:24][c:25]([NH2:26])[cH:27][c:28]1[CH3:29].[CH3:54][CH2:55][N:56]([CH2:57][CH3:58])[CH2:59][CH3:60].[Cl:1][c:2]1[c:3](-[c:9]2[nH:10][c:11]3[cH:12][c:13]([C:18](=[O:19])[OH:20])[cH:14][cH:15][c:16]3[cH:17]2)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1.[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[P-:30]([F:31])([F:32])([F:33])([F:34])([F:35])[F:36].[n:37]1([O:38][C:39]([N:40]([CH3:41])[CH3:42])=[N+:43]([CH3:44])[CH3:45])[c:46]2[n:47][cH:48][cH:49][cH:50][c:51]2[n:52][n:53]1>>[Cl:1][c:2]1[c:3](-[c:9]2[nH:10][c:11]3[cH:12][c:13]([C:18](=[O:20])[NH:26][c:25]4[cH:24][cH:23][c:22]([CH3:21])[c:28]([CH3:29])[cH:27]4)[cH:14][cH:15][c:16]3[cH:17]2)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 72483,4-DimethylanilineHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 669660532-(2,6-dichlorophenyl)-1H-indole-6-carboxylic acid

Product 1

HCID 669655772-(2,6-dichlorophenyl)-1H-indole-6-carboxylic acid (3,4-dimethylphenyl)-amide

Sources & evidence

ORD record
ord-2f3a9bbf520d40e58a6d8ccbd6051eda
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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