Methanol → 2-[4-(2,3-difluoro-phenyl)-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 1131306Notes

Reaction equation

HRID 1131306 reaction equation
[CH2:40]1[CH2:41][CH2:42][NH:43][CH2:44][CH2:45]1.[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.[CH3:46][OH:47].[F:22][c:23]1[c:24](-[c:30]2[c:31]3[c:35]([cH:36][cH:37][cH:38]2)[NH:34][C:33](=[O:39])[CH2:32]3)[cH:25][cH:26][cH:27][c:28]1[F:29]>>[CH3:1][c:2]1[c:3]([CH:20]=[C:32]2[c:31]3[c:30](-[c:24]4[c:23]([F:22])[c:28]([F:29])[cH:27][cH:26][cH:25]4)[cH:38][cH:37][cH:36][c:35]3[NH:34][C:33]2=[O:39])[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

5

Reactant 4

HCID 887MethanolHCID 8082PiperidineHCID 225619714-(2,3-Difluoro-phenyl)-1,3-dihydro-indol-2-oneHCID 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 685225782-[4-(2,3-difluoro-phenyl)-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-f11a4ab1efdc40cc98ebfaa5fe3298ae
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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