Dimethylformamide → 3-Chloro-N2-({4-chloro-3-[(3-chloro-5-cyanophenyl)oxy]-2-fluorophenyl}methyl)-1H-pyrrole-2,5-dicarboxamide

HRID 2124783Notes

Reaction equation

HRID 2124783 reaction equation
[CH:57]([N:58]([CH2:59][CH3:60])[CH:61]([CH3:62])[CH3:63])([CH3:64])[CH3:65].[NH2:25][C:26](=[O:27])[c:28]1[cH:29][c:30]([Cl:36])[c:31]([C:33](=[O:34])[OH:35])[nH:32]1.[NH2:37][CH2:38][c:39]1[c:40]([F:56])[c:41]([O:46][c:47]2[cH:48][c:49]([C:50]#[N:51])[cH:52][c:53]([Cl:55])[cH:54]2)[c:42]([Cl:45])[cH:43][cH:44]1.[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[NH2:25][C:26](=[O:27])[c:28]1[cH:29][c:30]([Cl:36])[c:31]([C:33](=[O:35])[NH:37][CH2:38][c:39]2[c:40]([F:56])[c:41]([O:46][c:47]3[cH:48][c:49]([C:50]#[N:51])[cH:52][c:53]([Cl:55])[cH:54]3)[c:42]([Cl:45])[cH:43][cH:44]2)[nH:32]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 594513923-{[3-(Aminomethyl)-6-chloro-2-fluorophenyl]oxy}-5-chlorobenzonitrileHCID 684804915-(Aminocarbonyl)-3-chloro-1H-pyrrole-2-carboxylic acid

Product 1

HCID 594513903-Chloro-N2-({4-chloro-3-[(3-chloro-5-cyanophenyl)oxy]-2-fluorophenyl}methyl)-1H-pyrrole-2,5-dicarboxamide

Sources & evidence

ORD record
ord-d31f3fb0296e4266a814f68d831032e5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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