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Dimethyl Sulfoxide → Ethyl 4-[4-[4-(2,6-dimethylmorpholin-4-yl)phenyl]piperazin-1-yl]benzoate

HRID 1114944
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HRID 1114944 반응식
[C:33](=[O:34])([O-:35])[O-:36].[CH2:21]([CH3:22])[O:23][C:24]([c:25]1[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]1)=[O:32].[CH3:1][CH:2]1[O:3][CH:4]([CH3:20])[CH2:5][N:6]([c:8]2[cH:9][cH:10][c:11]([N:14]3[CH2:15][CH2:16][NH:17][CH2:18][CH2:19]3)[cH:12][cH:13]2)[CH2:7]1.[CH3:40][S:41]([CH3:42])=[O:43].[Cl:44][CH2:45][Cl:46].[K+:37].[K+:38].[OH2:39]>>[CH3:1][CH:2]1[O:3][CH:4]([CH3:20])[CH2:5][N:6]([c:8]2[cH:9][cH:10][c:11]([N:14]3[CH2:15][CH2:16][N:17]([c:28]4[cH:27][cH:26][c:25]([C:24]([O:23][CH2:21][CH3:22])=[O:32])[cH:30][cH:29]4)[CH2:18][CH2:19]3)[cH:12][cH:13]2)[CH2:7]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2회HCID 962WaterHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 67976Benzoic acid, 4-fluoro-, ethyl esterHCID 571791102,6-Dimethyl-4-(4-piperazin-1-ylphenyl)morpholine

생성물 1

HCID 69677749Ethyl 4-[4-[4-(2,6-dimethylmorpholin-4-yl)phenyl]piperazin-1-yl]benzoate

출처 및 근거

ORD 기록
ord-e48744224ee74e4e938bc66cbe616ecd
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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