Dichloromethane → 2-chloro-N-[1-(1,3-dioxoisoindol-2-yl)-3-[2-(trifluoromethyl)phenyl]propan-2-yl]-1-methyl-5-(2-methylpyrazol-3-yl)pyrrole-3-carboxamide

HRID 93356Notes

Reaction equation

HRID 93356 reaction equation
[Br:58][P+:59]([N:60]1[CH2:61][CH2:62][CH2:63][CH2:64]1)([N:65]1[CH2:66][CH2:67][CH2:68][CH2:69]1)[N:70]1[CH2:71][CH2:72][CH2:73][CH2:74]1.[CH:42]([N:43]([CH2:44][CH3:45])[CH:46]([CH3:47])[CH3:48])([CH3:49])[CH3:50].[Cl:1][c:2]1[n:3]([CH3:16])[c:4](-[c:10]2[cH:11][cH:12][n:13][n:14]2[CH3:15])[cH:5][c:6]1[C:7](=[O:8])[OH:9].[Cl:75][CH2:76][Cl:77].[NH2:17][CH:18]([CH2:19][N:20]1[C:21](=[O:30])[c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]2[C:28]1=[O:29])[CH2:31][c:32]1[c:33]([C:38]([F:39])([F:40])[F:41])[cH:34][cH:35][cH:36][cH:37]1.[P-:51]([F:52])([F:53])([F:54])([F:55])([F:56])[F:57]>>[Cl:1][c:2]1[n:3]([CH3:16])[c:4](-[c:10]2[cH:11][cH:12][n:13][n:14]2[CH3:15])[cH:5][c:6]1[C:7](=[O:9])[NH:17][CH:18]([CH2:19][N:20]1[C:21](=[O:30])[c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]2[C:28]1=[O:29])[CH2:31][c:32]1[c:33]([C:38]([F:39])([F:40])[F:41])[cH:34][cH:35][cH:36][cH:37]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 2733180Bromotripyrrolidin-1-ylphosphoniumHCID 581729182-chloro-1-methyl-5-(1-methyl-1H-pyrazol-5-yl)-1H-pyrrole-3-carboxylic acidHCID 1785107622-[2-amino-3-[2-(trifluoromethyl)phenyl]propyl]isoindole-1,3-dione

Product 1

HCID 766930062-chloro-N-[1-(1,3-dioxoisoindol-2-yl)-3-[2-(trifluoromethyl)phenyl]propan-2-yl]-1-methyl-5-(2-methylpyrazol-3-yl)pyrrole-3-carboxamide

Sources & evidence

ORD record
ord-bbb8cd6a2a9a41329775f3290304dbfa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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