tert-Butanol → HCID 59420736, compound

HRID 197256Notes

Reaction equation

HRID 197256 reaction equation
[C:39]([OH:40])([CH3:41])([CH3:42])[CH3:43].[CH3:1][c:2]1[cH:3][c:4]([NH:7][c:8]2[cH:9][c:10]([CH2:15][C:16](=[O:17])[O:18][CH2:19][CH3:20])[n:11][c:12]([Cl:14])[n:13]2)[n:5][nH:6]1.[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[SH:21][c:22]1[cH:23][cH:24][c:25]([NH:28][C:29]([CH2:30][CH3:31])=[O:32])[cH:26][cH:27]1>>[CH3:1][c:2]1[cH:3][c:4]([NH:7][c:8]2[cH:9][c:10]([CH2:15][C:16](=[O:17])[O:18][CH2:19][CH3:20])[n:11][c:12]([S:21][c:22]3[cH:23][cH:24][c:25]([NH:28][C:29]([CH2:30][CH3:31])=[O:32])[cH:26][cH:27]3)[n:13]2)[n:5][nH:6]1

Participants

5

Reactant 4

HCID 6386tert-ButanolHCID 8857Ethyl AcetateHCID 45119426HCID 45119426, compoundHCID 59420848HCID 59420848, compound

Product 1

HCID 59420736HCID 59420736, compound

Sources & evidence

ORD record
ord-a977bcb961ed4f82a21520d4a3822bf4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…