Ethanol → HCID 178474585, compound

HRID 175224Notes

Reaction equation

HRID 175224 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:7][O:8][CH:9]2[CH2:10][n:11]3[c:12]([n:15][c:16]([N+:18](=[O:19])[O-:20])[cH:17]3)[O:13][CH2:14]2)[s:6]1.[CH3:54][CH2:55][OH:56].[CH3:57][c:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1.[F:21][c:22]1[cH:23][c:24]([N:37]2[C:38](=[O:47])[O:39][CH:40]([CH2:42][NH:43][C:44]([CH3:45])=[O:46])[CH2:41]2)[cH:25][cH:26][c:27]1[B:28]1[O:29][C:30]([CH3:31])([CH3:32])[C:33]([CH3:34])([CH3:35])[O:36]1.[K+:48].[K+:49].[O-:50][C:51]([O-:52])=[O:53].[O:64]=[CH:65][N:66]([CH3:67])[CH3:68]>>[c:2]1(-[c:27]2[c:22]([F:21])[cH:23][c:24]([N:37]3[C:38](=[O:47])[O:39][CH:40]([CH2:42][NH:43][C:44]([CH3:45])=[O:46])[CH2:41]3)[cH:25][cH:26]2)[cH:3][cH:4][c:5]([CH2:7][O:8][CH:9]2[CH2:10][n:11]3[c:12]([n:15][c:16]([N+:18](=[O:19])[O-:20])[cH:17]3)[O:13][CH2:14]2)[s:6]1

Participants

8

Reactant 7

HCID 702EthanolHCID 813Potassium Cation2×HCID 1140TolueneHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 22273985N-{3-[3-Fluoro-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-2-oxo-oxazolidin-5-ylmethyl}-acetamideHCID 1785267556-[(5-bromothiophen-2-yl)methoxy]-2-nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine

Product 1

HCID 178474585HCID 178474585, compound

Sources & evidence

ORD record
ord-f3daad73e63045dcb6387c7e161c9efd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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