4-((Trifluoromethyl)thio)aniline → [2-(5,6-dimethoxy-1-methyl-1H-indol-3-yl)-1-(toluene-4-sulfonyl)-1H-pyrrolo[2,3-b]pyrid-4-ylmethyl](4-trifluoromethylsulfanylphenyl)amine

HRID 313020Notes

Reaction equation

HRID 313020 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6](-[c:15]3[cH:16][c:17]4[c:18]([n:19][cH:20][cH:21][c:22]4[CH:23]=[O:24])[n:25]3[S:26](=[O:27])(=[O:28])[c:29]3[cH:30][cH:31][c:32]([CH3:35])[cH:33][cH:34]3)[cH:7][n:8]([CH3:14])[c:9]2[cH:10][c:11]1[O:12][CH3:13].[F:36][C:37]([F:38])([F:39])[S:40][c:41]1[cH:42][cH:43][c:44]([NH2:45])[cH:46][cH:47]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6](-[c:15]3[cH:16][c:17]4[c:18]([n:19][cH:20][cH:21][c:22]4[CH2:23][NH:45][c:44]4[cH:43][cH:42][c:41]([S:40][C:37]([F:36])([F:38])[F:39])[cH:47][cH:46]4)[n:25]3[S:26](=[O:27])(=[O:28])[c:29]3[cH:30][cH:31][c:32]([CH3:35])[cH:33][cH:34]3)[cH:7][n:8]([CH3:14])[c:9]2[cH:10][c:11]1[O:12][CH3:13]

Participants

3

Reactant 2

HCID 1230544-((Trifluoromethyl)thio)anilineHCID 866121402-(5,6-Dimethoxy-1-methylindol-3-yl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine-4-carbaldehyde

Product 1

HCID 67148271[2-(5,6-dimethoxy-1-methyl-1H-indol-3-yl)-1-(toluene-4-sulfonyl)-1H-pyrrolo[2,3-b]pyrid-4-ylmethyl](4-trifluoromethylsulfanylphenyl)amine

Sources & evidence

ORD record
ord-71b4503ce2204a0f9642e218ef0bddee
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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