4-(Azetidin-3-yl)-2,6-dimethylmorpholine → 5-[[1-[[2,4-Bis(trifluoromethyl)phenyl]methyl]indazol-5-yl]methylidene]-2-[3-(2,6-dimethylmorpholin-4-yl)azetidin-1-yl]-1,3-thiazol-4-one

HRID 100964

반응식

HRID 100964 반응식
[F:1][C:2]([c:3]1[c:4]([CH2:5][n:6]2[n:7][cH:8][c:9]3[cH:10][c:11]([CH:15]=[C:16]4[C:17](=[O:24])[N:18]=[C:19]([S:21][CH2:22][CH3:23])[S:20]4)[cH:12][cH:13][c:14]23)[cH:25][cH:26][c:27]([C:29]([F:30])([F:31])[F:32])[cH:28]1)([F:33])[F:34].[NH:35]1[CH2:36][CH:37]([N:39]2[CH2:40][CH:41]([CH3:46])[O:42][CH:43]([CH3:45])[CH2:44]2)[CH2:38]1>>[F:1][C:2]([c:3]1[c:4]([CH2:5][n:6]2[n:7][cH:8][c:9]3[cH:10][c:11]([CH:15]=[C:16]4[C:17](=[O:24])[N:18]=[C:19]([N:35]5[CH2:36][CH:37]([N:39]6[CH2:40][CH:41]([CH3:46])[O:42][CH:43]([CH3:45])[CH2:44]6)[CH2:38]5)[S:20]4)[cH:12][cH:13][c:14]23)[cH:25][cH:26][c:27]([C:29]([F:30])([F:31])[F:32])[cH:28]1)([F:33])[F:34]

참가 물질

3

반응물 2

HCID 627859194-(Azetidin-3-yl)-2,6-dimethylmorpholineHCID 866545405-[1-(2,4-Bis-trifluoromethyl-benzyl)-1H-indazol-5-ylmethylene]-2-ethylsulfanyl-thiazol-4-one

생성물 1

HCID 1240351195-[[1-[[2,4-Bis(trifluoromethyl)phenyl]methyl]indazol-5-yl]methylidene]-2-[3-(2,6-dimethylmorpholin-4-yl)azetidin-1-yl]-1,3-thiazol-4-one

출처 및 근거

ORD 기록
ord-0598af022ad34fe2b04e32fca562095a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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