Ethanol → 2-(2-(O-tolylamino)benzo[d]oxazol-6-yl)acetic acid

HRID 157811Notes

Reaction equation

HRID 157811 reaction equation
[CH3:66][CH2:67][OH:68].[CH:51]1([N:52]=[C:53]=[N:54][CH:55]2[CH2:56][CH2:57][CH2:58][CH2:59][CH2:60]2)[CH2:61][CH2:62][CH2:63][CH2:64][CH2:65]1.[c:1]1([CH3:40])[c:2]([NH:7][c:8]2[o:9][c:10]3[c:11]([n:12]2)[cH:13][cH:14][c:15]([CH2:17][C:18](=[O:19])[NH:20][c:21]2[cH:22][cH:23][c:24]([C:25]4([CH2:26][C:27]([OH:28])=[O:29])[CH2:30][c:31]5[c:32]([cH:33][cH:34][cH:35][cH:36]5)[CH2:37]4)[cH:38][cH:39]2)[cH:16]3)[cH:3][cH:4][cH:5][cH:6]1.[c:41]1([CH3:42])[c:43]([N:44]=[C:45]=[S:46])[cH:47][cH:48][cH:49][cH:50]1>>[c:1]1([CH3:40])[c:2]([NH:7][c:8]2[o:9][c:10]3[c:11]([n:12]2)[cH:13][cH:14][c:15]([CH2:17][C:18]([OH:19])=[O:68])[cH:16]3)[cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 702EthanolHCID 10868DicyclohexylcarbodiimideHCID 691952-Methylphenyl isothiocyanateHCID 10119302(2-{4-[2-(2-o-Tolylamino-benzoxazol-6-yl)-acetylamino]-phenyl}-indan-2-yl)-acetic Acid

Product 1

HCID 235083152-(2-(O-tolylamino)benzo[d]oxazol-6-yl)acetic acid

Sources & evidence

ORD record
ord-4b920c4a9d134437b787f36a6145365c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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