3-Nitrobenzenesulfonyl chloride → HCID 9871166, compound

HRID 1116989Notes

Reaction equation

HRID 1116989 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.[CH2:39]([NH:40][C:41]([c:42]1[c:43](-[c:44]2[cH:45][cH:46][cH:47][cH:48][c:49]2[CH:50]([S:51]([c:52]2[cH:53][cH:54][cH:55][c:56]([N+:57]([O-:58])=[O:59])[cH:60]2)(=[O:61])=[O:62])[NH2:63])[cH:64][cH:65][cH:66][cH:67]1)=[O:68])[CH2:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1.[N+:26](=[O:27])([O-:28])[c:29]1[cH:30][c:31]([S:35](=[O:36])(=[O:37])[Cl:38])[cH:32][cH:33][cH:34]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:35]([c:31]3[cH:30][c:29]([N+:26](=[O:27])[O-:28])[cH:34][cH:33][cH:32]3)(=[O:36])=[O:37])[cH:20][cH:21][cH:22][cH:23]2)[cH:14][cH:15][cH:16][cH:17]1

Participants

4

Reactant 3

HCID 84763-Nitrobenzenesulfonyl chlorideHCID 155093842'-(Aminomethyl)-N-(2-phenylethyl)[1,1'-biphenyl]-2-carboxamideHCID 68973753HCID 68973753, compound

Product 1

HCID 9871166HCID 9871166, compound

Sources & evidence

ORD record
ord-6a754332c36d46c49b1d927b8aaa6975
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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