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Hydrochloric Acid → 1,1-Dicyclohexyl-3-[5-(4-ethanesulfonyl-1-piperazinyl methyl)-thiazol-2-yl]-urea

HRID 206660
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HRID 206660 반응식
[C:36]([O:37][BH-:38]([O:39][C:40](=[O:41])[CH3:42])[O:43][C:44](=[O:45])[CH3:46])(=[O:47])[CH3:48].[CH2:25]([CH3:26])[S:27](=[O:28])(=[O:29])[N:30]1[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]1.[CH:1]1([N:7]([C:8](=[O:9])[NH:10][c:11]2[s:12][c:13]([CH:16]=[O:17])[cH:14][n:15]2)[CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[ClH:24].[Na+:49]>>[CH:1]1([N:7]([C:8](=[O:9])[NH:10][c:11]2[s:12][c:13]([CH2:16][N:33]3[CH2:32][CH2:31][N:30]([S:27]([CH2:25][CH3:26])(=[O:28])=[O:29])[CH2:35][CH2:34]3)[cH:14][n:15]2)[CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 923Sodium IonHCID 4152941-(Ethanesulfonyl)piperazineHCID 2724942TriacetoxyborohydrideHCID 578834711,1-Dicyclohexyl-3-(5-formyl-thiazol-2-yl)-urea

생성물 1

HCID 578836811,1-Dicyclohexyl-3-[5-(4-ethanesulfonyl-1-piperazinyl methyl)-thiazol-2-yl]-urea

출처 및 근거

ORD 기록
ord-8d7e2c04abfd481f99db3cb034ef7b33
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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