Benzene → HCID 21455445, compound

HRID 1132661Notes

Reaction equation

HRID 1132661 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7][c:8]([N:10]2[C:11](=[O:18])[N:12]([CH3:17])[CH2:13][CH2:14][CH:15]2[OH:16])[s:9]1.[CH3:19][C:20](=[O:21])[O:22][C:23](=[O:24])[CH3:25].[c:26]1([CH3:27])[c:28]([S:29]([OH:30])(=[O:31])=[O:32])[cH:33][cH:34][cH:35][cH:36]1.[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7][c:8]([N:10]2[C:11](=[O:18])[N:12]([CH3:17])[CH2:13][CH2:14][CH:15]2[O:16][C:20]([CH3:19])=[O:21])[s:9]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 69252-Methylbenzenesulfonic acidHCID 7918Acetic AnhydrideHCID 21400082tetrahydro-1-(5-t-butyl-1,3,4-thiadiazol-2-yl)-3-methyl-6-hydroxy-2(1H)-pyrimidinone

Product 1

HCID 21455445HCID 21455445, compound

Sources & evidence

ORD record
ord-38f52d6d069e43c99a924a7d7c8cc496
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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