Benzene → HCID 69535221, compound

HRID 1554813Notes

Reaction equation

HRID 1554813 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]3[c:16]([Br:23])[cH:17][nH:18][c:19]3[cH:20][cH:21][cH:22]2)[CH2:12][CH2:13]1.[CH3:24][C:25]([CH3:26])([O-:27])[CH3:28].[Na+:29].[c:30]1([S:36](=[O:37])(=[O:38])[Cl:39])[cH:31][cH:32][cH:33][cH:34][cH:35]1.[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]3[c:16]([Br:23])[cH:17][n:18]([S:36]([c:30]4[cH:31][cH:32][cH:33][cH:34][cH:35]4)(=[O:37])=[O:38])[c:19]3[cH:20][cH:21][cH:22]2)[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 241BenzeneHCID 923Sodium ionHCID 7369Benzenesulfonyl chlorideHCID 45749132-Methylpropan-2-olateHCID 69535222HCID 69535222, compound

Product 1

HCID 69535221HCID 69535221, compound

Sources & evidence

ORD record
ord-89db6c4af65f4f878c5e6fdb3a1eed38
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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