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Dichloromethane → CID 77569780

HRID 154375
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HRID 154375 반응식
[CH3:1][S:2]([O:3][CH2:6][c:7]1[cH:8][c:9]2[c:10]([cH:11][n:12]1)[n:13][cH:14][n:15]2-[c:16]1[s:17][c:18]([C:34]([NH2:35])=[O:36])[c:19]([O:21][CH:22]([CH3:23])[c:24]2[c:25]([C:30]([F:31])([F:32])[F:33])[cH:26][cH:27][cH:28][cH:29]2)[cH:20]1)(=[O:4])=[O:5].[Cl:51][CH2:52][Cl:53].[O:37]=[C:38]([CH2:39][N:40]1[CH2:41][CH2:42][NH:43][CH2:44][CH2:45]1)[N:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1>>[CH2:6]([c:7]1[cH:8][c:9]2[c:10]([cH:11][n:12]1)[n:13][cH:14][n:15]2-[c:16]1[s:17][c:18]([C:34]([NH2:35])=[O:36])[c:19]([O:21][CH:22]([CH3:23])[c:24]2[c:25]([C:30]([F:31])([F:32])[F:33])[cH:26][cH:27][cH:28][cH:29]2)[cH:20]1)[N:43]1[CH2:42][CH2:41][N:40]([CH2:39][C:38](=[O:37])[N:46]2[CH2:47][CH2:48][CH2:49][CH2:50]2)[CH2:45][CH2:44]1
참가 물질출처 및 근거반응 노트

참가 물질

4

반응물 3

HCID 6344DichloromethaneHCID 1006141-((Pyrrolidine-1-carbonyl)methyl)piperazineHCID 86647104[1-(5-carbamoyl-4-{1-[2-(trifluoromethyl)phenyl]ethoxy}-2-thienyl)-1H-imidazo[4,5-c]pyridin-6-yl]methyl methanesulfonate

생성물 1

HCID 178466901CID 77569780

출처 및 근거

ORD 기록
ord-12184b019ce54943bd9381615bf58fe9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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