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Acetone → Methyl 2-(2-(benzyloxy)-5-(2-(thiomorpholin-4-yl)ethoxy)benzamido)-4-phenylbenzoate

HRID 292756
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HRID 292756 반응식
[C:1](=[O:2])([O-:3])[O-:4].[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[O:20][c:21]1[c:22]([C:23](=[O:24])[NH:25][c:26]2[c:27]([C:28](=[O:29])[O:30][CH3:31])[cH:32][cH:33][c:34](-[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[cH:35]2)[cH:42][c:43]([O:46][CH2:47][CH2:48][Br:49])[cH:44][cH:45]1.[CH2:7]1[CH2:8][S:9][CH2:10][CH2:11][NH:12]1.[CH3:50][C:51](=[O:52])[CH3:53].[K+:5].[K+:6]>>[CH2:7]1[CH2:8][S:9][CH2:10][CH2:11][N:12]1[CH2:48][CH2:47][O:46][c:43]1[cH:42][c:22]([C:23](=[O:24])[NH:25][c:26]2[c:27]([C:28](=[O:29])[O:30][CH3:31])[cH:32][cH:33][c:34](-[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[cH:35]2)[c:21]([O:20][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:45][cH:44]1
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6

반응물 5

HCID 180AcetoneHCID 813Potassium Cation2회HCID 19660Carbonate IonHCID 67164ThiomorpholineHCID 66990627Methyl 2-(2-(benzyloxy)-5-(2-bromoethoxy)benzamido)-4-phenylbenzoate

생성물 1

HCID 66990890Methyl 2-(2-(benzyloxy)-5-(2-(thiomorpholin-4-yl)ethoxy)benzamido)-4-phenylbenzoate

출처 및 근거

ORD 기록
ord-492da83b2ca54f7396d5922c7c914ec7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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