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Hydrochloric Acid → {3-(3-Cyclopropyl-1,2,4-oxadiazol-5-yl)-5-[4-(trifluoromethyl)phenyl]piperidin-1-yl}(3-methyl-azetidin-1-yl)methanone

HRID 307953
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반응식

HRID 307953 반응식
[CH3:38][CH:39]1[CH2:40][NH:41][CH2:42]1.[CH:1]1([c:4]2[n:5][o:6][c:7]([CH:9]3[CH2:10][N:11]([C:25]([O:27][c:26]4[cH:28][cH:29][c:30]([N+:31]([O-:32])=[O:33])[cH:34][cH:35]4)=[O:36])[CH2:12][CH:13]([c:15]4[cH:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]4)[CH2:14]3)[n:8]2)[CH2:2][CH2:3]1.[ClH:37]>>[CH:1]1([c:4]2[n:5][o:6][c:7]([CH:9]3[CH2:10][N:11]([C:25](=[O:27])[N:41]4[CH2:40][CH:39]([CH3:38])[CH2:42]4)[CH2:12][CH:13]([c:15]4[cH:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]4)[CH2:14]3)[n:8]2)[CH2:2][CH2:3]1
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반응물 3

HCID 313Hydrochloric AcidHCID 199959423-methylAzetidineHCID 580021744-Nitrophenyl 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5-[4-(trifluoromethyl)phenyl]piperidine-1-carboxylate

생성물 1

HCID 58002596{3-(3-Cyclopropyl-1,2,4-oxadiazol-5-yl)-5-[4-(trifluoromethyl)phenyl]piperidin-1-yl}(3-methyl-azetidin-1-yl)methanone

출처 및 근거

ORD 기록
ord-27fae406f3824ce0b6526ec12785ae91
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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