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Acetone → N-[2-(benzylthio)-3-oxopropyl]-4-methyl-7-[methyl(2-thienylsulfonyl)amino]-1H-indole-2-carboxamide

HRID 286072
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인쇄 미리보기

반응식

HRID 286072 반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[S:8][CH:9]([CH2:10][NH:11][C:12](=[O:13])[c:14]1[nH:15][c:16]2[c:17]([N:24]([S:25](=[O:26])(=[O:27])[c:28]3[s:29][cH:30][cH:31][cH:32]3)[CH3:33])[cH:18][cH:19][c:20]([CH3:23])[c:21]2[cH:22]1)[CH:34]([O:35][CH3:38])[O:36][CH3:37].[CH3:39][C:40](=[O:41])[CH3:42].[OH2:43]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[S:8][CH:9]([CH2:10][NH:11][C:12](=[O:13])[c:14]1[nH:15][c:16]2[c:17]([N:24]([S:25](=[O:26])(=[O:27])[c:28]3[s:29][cH:30][cH:31][cH:32]3)[CH3:33])[cH:18][cH:19][c:20]([CH3:23])[c:21]2[cH:22]1)[CH:34]=[O:35]
참가 물질출처 및 근거반응 노트

참가 물질

4

반응물 3

HCID 180AcetoneHCID 962WaterHCID 59135744N-[2-(benzylthio)-3,3-dimethoxypropyl]-4-methyl-7-[methyl(2-thienylsulfonyl)amino]-1H-indole-2-carboxamide

생성물 1

HCID 59135719N-[2-(benzylthio)-3-oxopropyl]-4-methyl-7-[methyl(2-thienylsulfonyl)amino]-1H-indole-2-carboxamide

출처 및 근거

ORD 기록
ord-4a459210fc714ceba4a7c48a72cda061
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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