Water → 2,4-Dimethyl-5-(2-oxo-4-pyridin-3-yl-1,2-dihydroindol-3-ylidenemethyl)-1H-pyrrole-3-carboxylic Acid (2-diethylaminoethyl) amide

HRID 186891Notes

Reaction equation

HRID 186891 reaction equation
[CH2:17]([CH3:18])[N:19]([CH2:20][CH2:21][NH:22][C:23](=[O:24])[c:25]1[c:26]([CH3:33])[nH:27][c:28]([CH:31]=[O:32])[c:29]1[CH3:30])[CH2:34][CH3:35].[CH2:36]1[CH2:37][CH2:38][NH:39][CH2:40][CH2:41]1.[OH2:42].[n:1]1[cH:2][c:3](-[c:7]2[c:8]3[c:12]([cH:13][cH:14][cH:15]2)[NH:11][C:10](=[O:16])[CH2:9]3)[cH:4][cH:5][cH:6]1>>[n:1]1[cH:2][c:3](-[c:7]2[c:8]3[c:12]([cH:13][cH:14][cH:15]2)[NH:11][C:10](=[O:16])[C:9]3=[CH:31][c:28]2[nH:27][c:26]([CH3:33])[c:25]([C:23]([NH:22][CH2:21][CH2:20][N:19]([CH2:17][CH3:18])[CH2:34][CH3:35])=[O:24])[c:29]2[CH3:30])[cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 962WaterHCID 8082PiperidineHCID 20761785N-(2-(diethylamino)ethyl)-5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxamideHCID 221354074-Pyridin-3-yl-1,3-dihydroindol-2-one

Product 1

HCID 249412192,4-Dimethyl-5-(2-oxo-4-pyridin-3-yl-1,2-dihydroindol-3-ylidenemethyl)-1H-pyrrole-3-carboxylic Acid (2-diethylaminoethyl) amide

Sources & evidence

ORD record
ord-602cb021aa2842ddbb28cf9e2e2ab3ad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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