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Chloride → Ethyl 2-(5-bromo-3-(trans-4-methoxycyclohexylamino)pyrazin-2-ylamino)acetate

HRID 115688
노트
인쇄 미리보기

반응식

HRID 115688 반응식
[Br:1][c:2]1[c:3]([NH:9][CH2:10][C:11](=[O:12])[O:13][CH2:14][CH3:15])[n:4][cH:5][c:6]([Br:8])[n:7]1.[CH3:17][O:18][CH:19]1[CH2:20][CH2:21][CH:22]([NH2:25])[CH2:23][CH2:24]1.[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[CH3:43][N:44]1[CH2:45][CH2:46][CH2:47][C:48]1=[O:49].[CH:26]([N:27]([CH2:28][CH3:29])[CH:30]([CH3:31])[CH3:32])([CH3:33])[CH3:34].[Cl-:36].[ClH:16].[Na+:35]>>[c:2]1([NH:25][CH:22]2[CH2:21][CH2:20][CH:19]([O:18][CH3:17])[CH2:24][CH2:23]2)[c:3]([NH:9][CH2:10][C:11](=[O:12])[O:13][CH2:14][CH3:15])[n:4][cH:5][c:6]([Br:8])[n:7]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 312ChlorideHCID 313Hydrochloric AcidHCID 923Sodium IonHCID 8857Ethyl AcetateHCID 13387N-methyl-2-pyrrolidoneHCID 81531DiisopropylethylamineHCID 409910(trans-4-Methoxycyclohexyl)amine
HCID 57550751
Ethyl 2-(3,5-dibromopyrazin-2-ylamino)acetate

생성물 1

HCID 86293006Ethyl 2-(5-bromo-3-(trans-4-methoxycyclohexylamino)pyrazin-2-ylamino)acetate

출처 및 근거

ORD 기록
ord-61a1be78bde342dea23663aaf2ab4d7b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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