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Hydrochloric Acid → 2-(3-Ethoxy-azetidin-1-yl)-N-(4-methoxy-7-morpholin-4-yl-benzothiazol-2-yl)-isonicotinamide

HRID 308971
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반응식

HRID 308971 반응식
[Br:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[s:9][c:10]3[c:11]([n:12]2)[c:13]([O:23][CH3:24])[cH:14][cH:15][c:16]3[N:17]2[CH2:18][CH2:19][O:20][CH2:21][CH2:22]2)[cH:25][cH:26][n:27]1.[C:28](=[O:29])([O-:30])[O-:31].[CH2:35]([CH3:36])[O:37][CH:38]1[CH2:39][NH:40][CH2:41]1.[CH3:42][N:43]1[CH2:44][CH2:45][CH2:46][C:47]1=[O:48].[ClH:34].[Cs+:32].[Cs+:33]>>[c:2]1([N:40]2[CH2:39][CH:38]([O:37][CH2:35][CH3:36])[CH2:41]2)[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[s:9][c:10]3[c:11]([n:12]2)[c:13]([O:23][CH3:24])[cH:14][cH:15][c:16]3[N:17]2[CH2:18][CH2:19][O:20][CH2:21][CH2:22]2)[cH:25][cH:26][n:27]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 13387N-methyl-2-pyrrolidoneHCID 19660Carbonate IonHCID 104967Cesium cation2회HCID 225077333-EthoxyazetidineHCID 229934292-bromo-N-(4-methoxy-7-morpholin-4-yl-benzothiazol-2-yl)-isonicotinamide

생성물 1

HCID 10227046
2-(3-Ethoxy-azetidin-1-yl)-N-(4-methoxy-7-morpholin-4-yl-benzothiazol-2-yl)-isonicotinamide

출처 및 근거

ORD 기록
ord-196d6917ac2e4b3e982cba656950a728
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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