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Dichloromethane → N-({[2-(4-{2-Ethyl-5-[1-(methyloxy)ethyl]-1H-benzimidazol-1-YL]phenyl)ethyl]amino}carbonyl)-4-methylbenzenesulfonamide

HRID 158095
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HRID 158095 반응식
[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7]1-[c:8]1[cH:9][cH:10][c:11]([CH2:14][CH2:15][NH:16][C:17](=[O:18])[NH:19][S:20](=[O:21])(=[O:22])[c:23]3[cH:24][cH:25][c:26]([CH3:29])[cH:27][cH:28]3)[cH:12][cH:13]1)[cH:30][cH:31][c:32]([CH:34]([CH3:35])[OH:36])[cH:33]2.[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[Cl:48][CH2:49][Cl:50].[S:37]([Cl:38])([Cl:39])=[O:40]>>[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7]1-[c:8]1[cH:9][cH:10][c:11]([CH2:14][CH2:15][NH:16][C:17](=[O:18])[NH:19][S:20](=[O:21])(=[O:22])[c:23]3[cH:24][cH:25][c:26]([CH3:29])[cH:27][cH:28]3)[cH:12][cH:13]1)[cH:30][cH:31][c:32]([CH:34]([CH3:35])[O:36][CH3:41])[cH:33]2
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 24386Thionyl ChlorideHCID 21876255N-[{(2-{4-[2-ethyl-5-(1-hydroxyethyl)-1H-benzimidazol-1-yl]phenyl}ethyl)amino]carbonyl}-4-methylbenzenesulfonamide

생성물 1

HCID 21875610N-({[2-(4-{2-Ethyl-5-[1-(methyloxy)ethyl]-1H-benzimidazol-1-YL]phenyl)ethyl]amino}carbonyl)-4-methylbenzenesulfonamide

출처 및 근거

ORD 기록
ord-45670e9b0a5e420c8641eff7b0df7046
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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