Acetic Acid → 2-[6-(1H-Indol-4-yl)-1H-indazol-4-yl]-2,3-dihydro-1H-isoindol-1-one

HRID 205011

Reaction equation

[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[CH3:36][C:37](=[O:38])[OH:39].[c:20]1([CH:28]=[O:29])[c:21]([CH:26]=[O:27])[cH:22][cH:23][cH:24][cH:25]1.[nH:1]1[cH:2][cH:3][c:4]2[c:5](-[c:10]3[cH:11][c:12]([NH2:19])[c:13]4[cH:14][n:15][nH:16][c:17]4[cH:18]3)[cH:6][cH:7][cH:8][c:9]12>>[nH:1]1[cH:2][cH:3][c:4]2[c:5](-[c:10]3[cH:11][c:12]([N:19]4[C:26](=[O:27])[c:21]5[c:20]([cH:25][cH:24][cH:23][cH:22]5)[CH2:28]4)[c:13]4[cH:14][n:15][nH:16][c:17]4[cH:18]3)[cH:6][cH:7][cH:8][c:9]12

Participants

Reactant 4

HCID 176Acetic Acid

HCID 4807Phthalaldehyde

HCID 8857Ethyl Acetate

HCID 582680196-(1H-indol-4-yl)-1H-indazol-4-amine

Product 1

HCID 445404012-[6-(1H-Indol-4-yl)-1H-indazol-4-yl]-2,3-dihydro-1H-isoindol-1-one

Sources & evidence

ORD record: ord-d812f5e34eba46959ab243aecf6c7d0d
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Linked notes

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