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Dichloromethane → N-[1-(3,4-Dichloro-benzyl)-azetidin-3-ylmethyl]-2-(6-ethoxy-benzothiazol-2-ylsulfanyl)-acetamide

HRID 193973
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HRID 193973 반응식
[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]2[c:7]([n:8][c:9]([S:11][CH2:12][C:13](=[O:14])[OH:15])[s:10]2)[cH:16][cH:17]1.[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[Cl:42][c:43]1[cH:44][c:45]([CH2:46][N:47]2[CH2:48][CH:49]([CH2:51][NH2:52])[CH2:50]2)[cH:53][cH:54][c:55]1[Cl:56].[Cl:57][CH2:58][Cl:59].[n:25]1([O:26][C:27](=[N+:28]([CH3:29])[CH3:30])[N:31]([CH3:32])[CH3:33])[c:34]2[cH:35][cH:36][cH:37][cH:38][c:39]2[n:40][n:41]1>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]2[c:7]([n:8][c:9]([S:11][CH2:12][C:13](=[O:15])[NH:52][CH2:51][CH:49]3[CH2:48][N:47]([CH2:46][c:45]4[cH:44][c:43]([Cl:42])[c:55]([Cl:56])[cH:54][cH:53]4)[CH2:50]3)[s:10]2)[cH:16][cH:17]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 9419442-[(6-Ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetic acidHCID 68712490HCID 68712490, 화합물

생성물 1

HCID 11511612N-[1-(3,4-Dichloro-benzyl)-azetidin-3-ylmethyl]-2-(6-ethoxy-benzothiazol-2-ylsulfanyl)-acetamide

출처 및 근거

ORD 기록
ord-8957da204c6d4adca48cd5eb4f6305b7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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