4-Ethylbenzene-1-sulfonyl chloride → HCID 9870530, compound

HRID 2134331Notes

Reaction equation

HRID 2134331 reaction equation
[CH2:1]([CH2:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[NH:9][C:10](=[O:11])[c:12]1[c:13](-[c:18]2[c:19]([CH2:24][NH2:25])[cH:20][cH:21][cH:22][cH:23]2)[cH:14][cH:15][cH:16][cH:17]1.[CH2:26]([CH3:27])[c:28]1[cH:29][cH:30][c:31]([S:34](=[O:35])(=[O:36])[Cl:37])[cH:32][cH:33]1.[CH2:38]([NH:39][C:40]([c:41]1[c:42](-[c:43]2[cH:44][cH:45][cH:46][cH:47][c:48]2[CH:49]([S:50]([c:51]2[cH:52][cH:53][c:54]([CH2:55][CH3:56])[cH:57][cH:58]2)(=[O:59])=[O:60])[NH2:61])[cH:62][cH:63][cH:64][cH:65]1)=[O:66])[CH2:67][c:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1>>[CH2:1]([CH2:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[NH:9][C:10](=[O:11])[c:12]1[c:13](-[c:18]2[c:19]([CH2:24][NH:25][S:34]([c:31]3[cH:30][cH:29][c:28]([CH2:26][CH3:27])[cH:33][cH:32]3)(=[O:35])=[O:36])[cH:20][cH:21][cH:22][cH:23]2)[cH:14][cH:15][cH:16][cH:17]1

Participants

4

Reactant 3

HCID 5709594-Ethylbenzene-1-sulfonyl chlorideHCID 155093842'-(Aminomethyl)-N-(2-phenylethyl)[1,1'-biphenyl]-2-carboxamideHCID 68968595HCID 68968595, compound

Product 1

HCID 9870530HCID 9870530, compound

Sources & evidence

ORD record
ord-b7f35567931848a9a2d3e1656a3c3b81
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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