Benzenesulfonyl chloride → HCID 67147742, compound

HRID 87010Notes

Reaction equation

[CH3:1][O:2][c:3]1[c:4]([CH2:5][NH:6][CH2:7][c:8]2[c:9]3[c:10]([n:11][cH:12][cH:13]2)[n:14]([S:31](=[O:32])(=[O:33])[c:34]2[cH:35][cH:36][c:37]([CH3:40])[cH:38][cH:39]2)[c:15](-[c:17]2[cH:18][n:19]([CH3:30])[c:20]4[cH:21][c:22]([O:28][CH3:29])[c:23]([O:26][CH3:27])[cH:24][c:25]24)[cH:16]3)[cH:41][cH:42][c:43]([O:45][CH3:46])[cH:44]1.[c:47]1([S:53](=[O:54])(=[O:55])[Cl:56])[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[CH3:1][O:2][c:3]1[c:4]([CH2:5][N:6]([CH2:7][c:8]2[c:9]3[c:10]([n:11][cH:12][cH:13]2)[n:14]([S:31](=[O:32])(=[O:33])[c:34]2[cH:35][cH:36][c:37]([CH3:40])[cH:38][cH:39]2)[c:15](-[c:17]2[cH:18][n:19]([CH3:30])[c:20]4[cH:21][c:22]([O:28][CH3:29])[c:23]([O:26][CH3:27])[cH:24][c:25]24)[cH:16]3)[S:53]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)(=[O:54])=[O:55])[cH:41][cH:42][c:43]([O:45][CH3:46])[cH:44]1

Participants

Reactant 2

HCID 7369Benzenesulfonyl chloride

HCID 67147711(2,4-dimethoxybenzyl) [2-(5,6-dimethoxy-1-methyl-1H-indol-3-yl)-1-(toluene-4-sulfonyl)-1H-pyrrolo[2,3-b]pyrid-4-ylmethyl]amine

Product 1

HCID 67147742HCID 67147742, compound

Sources & evidence

ORD record: ord-d5aa262d729248dc8ce02f9c781b3b70
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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