Hydrochloric Acid → Hydrochloric Acid

반응식

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

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 702Ethanol

HCID 140474512benzyl N-[4-[[[2-(2,6-difluoro-3-hydroxyphenyl)-2-ethoxyacetyl]amino]methyl]benzenecarboximidoyl]carbamate

생성물 2

HCID 313Hydrochloric Acid

HCID 21905431N-[(4-carbamimidoylphenyl)methyl]-2-(2,6-difluoro-3-hydroxyphenyl)-2-ethoxyacetamide

출처 및 근거

ORD 기록: ord-ef1e497bc3f442039d3766f3efb60367
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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