Ethanol → HCID 10304198, 화합물

HRID 1572698노트

반응식

HRID 1572698 반응식
[CH3:43][CH2:44][OH:45].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7][c:8]([CH:10]3[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]3)[o:9]2)[cH:16]1.[O:17]1[CH:18]([CH2:20][n:21]2[n:22][c:23](-[c:33]3[cH:34][cH:35][c:36]([C:39]([F:40])([F:41])[F:42])[cH:37][cH:38]3)[c:24]3[c:29]2[CH2:28][CH2:27][N:26]([C:30]([CH3:31])=[O:32])[CH2:25]3)[CH2:19]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7][c:8]([CH:10]3[CH2:11][CH2:12][N:13]([CH2:19][CH:18]([OH:17])[CH2:20][n:21]4[n:22][c:23](-[c:33]5[cH:34][cH:35][c:36]([C:39]([F:40])([F:41])[F:42])[cH:37][cH:38]5)[c:24]5[c:29]4[CH2:28][CH2:27][N:26]([C:30]([CH3:31])=[O:32])[CH2:25]5)[CH2:14][CH2:15]3)[o:9]2)[cH:16]1

참가 물질

4

반응물 3

HCID 702EthanolHCID 222936875-chloro-2-(piperidin-4-yl)-1,3-benzoxazoleHCID 222938171-[1-Oxiranylmethyl-3-(4-trifluoromethyl-phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone

생성물 1

HCID 10304198HCID 10304198, 화합물

출처 및 근거

ORD 기록
ord-6809c71ec1c748fe9c83eabaff5b7b34
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

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