Benzene → N-(2-t-butyl-1,3,4-thiadiazol-5-yl)-N'-(1,3-dioxolan-2-ylmethyl)-N'-ethylurea

HRID 125939Notes

Reaction equation

HRID 125939 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[s:6][c:7]([N:10]=[C:11]=[O:12])[n:8][n:9]1.[O:13]1[CH:14]([CH2:18][NH:19][CH2:20][CH3:21])[O:15][CH2:16][CH2:17]1.[cH:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[s:6][c:7]([NH:10][C:11](=[O:12])[N:19]([CH2:18][CH:14]2[O:13][CH2:17][CH2:16][O:15]2)[CH2:20][CH3:21])[n:8][n:9]1

Participants

4

Reactant 3

HCID 241BenzeneHCID 64524562-t-Butyl-1,3,4-thiadiazol-5-yl IsocyanateHCID 13193169N-(1,3-dioxolan-2-yl)methyl ethylamine

Product 1

HCID 21545055N-(2-t-butyl-1,3,4-thiadiazol-5-yl)-N'-(1,3-dioxolan-2-ylmethyl)-N'-ethylurea

Sources & evidence

ORD record
ord-34fe24e1d01a4ac9abd2383004b37932
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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