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Hydrochloric Acid → 1-(3-(Benzoylthio)-2-methylpropanoyl)-2-indolinecarboxylic acid

HRID 89336
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HRID 89336 반응식
[C:17]([c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)(=[O:24])[S:25][CH2:26][CH:27]([C:28](=[O:29])[Cl:30])[CH3:31].[CH2:14]([Cl:15])[Cl:16].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[ClH:1].[NH:2]1[CH:3]([C:11](=[O:12])[OH:13])[CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21>>[N:2]1([C:28]([CH:27]([CH2:26][S:25][C:17]([c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)=[O:24])[CH3:31])=[O:29])[CH:3]([C:11](=[O:12])[OH:13])[CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 86074Indoline-2-carboxylic acidHCID 12878433(1)-S-(3-Chloro-2-methyl-3-oxopropyl) benzenecarbothioate

생성물 1

HCID 4943231-(3-(Benzoylthio)-2-methylpropanoyl)-2-indolinecarboxylic acid

출처 및 근거

ORD 기록
ord-5b4d589656c1400fa2bea496a5cba8e1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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