5-Chlorooxindole → 2-(5-chloro-2-oxo-1,2-dihydro-indol-3-ylidenemethyl)-3-methyl-5-(2-pyrrolidin-1-yl-ethyl)-5,6,7,8-tetrahydro-1H-pyrrolo[3,2-c]azepin-4-one

HRID 286054Notes

Reaction equation

HRID 286054 reaction equation
[CH3:1][c:2]1[c:3]([CH:20]=[O:21])[nH:4][c:5]2[c:6]1[C:7](=[O:19])[N:8]([CH2:12][CH2:13][N:14]1[CH2:15][CH2:16][CH2:17][CH2:18]1)[CH2:9][CH2:10][CH2:11]2.[Cl:22][c:23]1[cH:24][c:25]2[c:29]([cH:30][cH:31]1)[NH:28][C:27](=[O:32])[CH2:26]2>>[CH3:1][c:2]1[c:3]([CH:20]=[C:26]2[c:25]3[cH:24][c:23]([Cl:22])[cH:31][cH:30][c:29]3[NH:28][C:27]2=[O:32])[nH:4][c:5]2[c:6]1[C:7](=[O:19])[N:8]([CH2:12][CH2:13][N:14]1[CH2:15][CH2:16][CH2:17][CH2:18]1)[CH2:9][CH2:10][CH2:11]2

Participants

3

Reactant 2

HCID 1528015-ChlorooxindoleHCID 592500963-Methyl-4-oxo-5-(2-pyrrolidin-1-yl-ethyl)-1,4,5,6,7,8-hexahydro-pyrrolo[3,2-c]azepine-2-carbaldehyde

Product 1

HCID 685248132-(5-chloro-2-oxo-1,2-dihydro-indol-3-ylidenemethyl)-3-methyl-5-(2-pyrrolidin-1-yl-ethyl)-5,6,7,8-tetrahydro-1H-pyrrolo[3,2-c]azepin-4-one

Sources & evidence

ORD record
ord-1d9b4b2acf8f4973ba4130b57422f3ac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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