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Hydrochloric Acid → 3-bromo-N-(4-chloro-2-(1-cyclopropylethylcarbamoyl)phenyl)-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide

HRID 1228365
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반응식

HRID 1228365 반응식
[Br:23][c:24]1[n:25][n:26](-[c:37]2[n:38][cH:39][cH:40][cH:41][c:42]2[Cl:43])[c:27]([C:29](=[O:30])[O:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36])[cH:28]1.[CH3:1][C:2]([CH3:3])([O-:4])[CH3:5].[CH3:45][S:46](=[O:47])[CH3:48].[ClH:44].[K+:6].[NH2:7][c:8]1[c:9]([C:10](=[O:11])[NH:12][CH:13]([CH3:14])[CH:15]2[CH2:16][CH2:17]2)[cH:18][c:19]([Cl:22])[cH:20][cH:21]1>>[NH:7]([c:8]1[c:9]([C:10](=[O:11])[NH:12][CH:13]([CH3:14])[CH:15]2[CH2:16][CH2:17]2)[cH:18][c:19]([Cl:22])[cH:20][cH:21]1)[C:29]([c:27]1[n:26](-[c:37]2[n:38][cH:39][cH:40][cH:41][c:42]2[Cl:43])[n:25][c:24]([Br:23])[cH:28]1)=[O:30]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 813Potassium CationHCID 45749132-Methylpropan-2-olateHCID 435330962-amino-5-chloro-N-(1-cyclopropylethyl)benzamideHCID 59549434pentyl 3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxylate

생성물 1

HCID 66736193
3-bromo-N-(4-chloro-2-(1-cyclopropylethylcarbamoyl)phenyl)-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide

출처 및 근거

ORD 기록
ord-6fed6b4f0bbf4d45ade466a907789940
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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