Ethanol → HCID 19434909, compound

HRID 1549022Notes

Reaction equation

[C:1]([O:2][C:3](=[O:7])[N:8]([CH2:4][O:5][CH3:6])[c:12]1[c:13]([F:38])[cH:14][c:15](-[c:18]2[o:19][c:20]3[c:21]([c:22](=[O:24])[cH:23]2)[c:25]([NH:31][CH2:32][CH2:33][CH:34]=[C:35]([CH3:36])[CH3:37])[c:26]([F:30])[cH:27][c:28]3[F:29])[cH:16][cH:17]1)([CH3:9])([CH3:10])[CH3:11].[CH3:45][CH2:46][OH:47].[OH2:44].[S:39](=[O:40])(=[O:41])([OH:42])[OH:43]>>[NH2:8][c:12]1[c:13]([F:38])[cH:14][c:15](-[c:18]2[o:19][c:20]3[c:21]([c:22](=[O:24])[cH:23]2)[c:25]([NH:31][CH2:32][CH2:33][CH:34]=[C:35]([CH3:36])[CH3:37])[c:26]([F:30])[cH:27][c:28]3[F:29])[cH:16][cH:17]1

Participants

Reactant 4

HCID 702Ethanol

HCID 962Water

HCID 1118Sulfuric Acid

HCID 194348222-[4-[N-(tert-butoxycarbonyl)-N-methoxymethylamino]-3-fluorophenyl]-6,8-difluoro-5-(4-methyl-3-pentenylamino)-4H-1-benzopyran-4-one

Product 1

HCID 19434909HCID 19434909, compound

Sources & evidence

ORD record: ord-b25417d978614edb9b4f031e8e671f60
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…