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Ammonium → {2-(3-Hydroxy-5-methoxyphenyl)-2-[4-(5-methyl-[1,2,4]oxadiazol-3-yl)phenylimino]-1-methylsulfanylethylidene}carbamic acid methyl ester

HRID 2314518
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HRID 2314518 반응식
[CH2:19]1[O:20][CH2:21][CH2:22][CH2:23]1.[CH2:2]([N+:3]([CH2:4][CH2:5][CH2:6][CH3:7])([CH2:8][CH2:9][CH2:10][CH3:11])[CH2:12][CH2:13][CH2:14][CH3:15])[CH2:16][CH2:17][CH3:18].[CH3:24][O:25][C:26]([N:27]=[C:28]([C:29](=[N:30][c:31]1[cH:32][cH:33][c:34](-[c:37]2[n:38][o:39][c:40]([CH3:42])[n:41]2)[cH:35][cH:36]1)[c:43]1[cH:44][c:45]([O:60][CH3:61])[cH:46][c:47]([O:49][Si:50]([CH:51]([CH3:52])[CH3:53])([CH:54]([CH3:55])[CH3:56])[CH:57]([CH3:58])[CH3:59])[cH:48]1)[S:62][CH3:63])=[O:64].[CH3:67][CH2:68][O:69][C:70](=[O:71])[CH3:72].[Cl-:65].[F-:1].[NH4+:66]>>[CH3:24][O:25][C:26]([N:27]=[C:28]([C:29](=[N:30][c:31]1[cH:32][cH:33][c:34](-[c:37]2[n:38][o:39][c:40]([CH3:42])[n:41]2)[cH:35][cH:36]1)[c:43]1[cH:44][c:45]([O:60][CH3:61])[cH:46][c:47]([OH:49])[cH:48]1)[S:62][CH3:63])=[O:64]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 223AmmoniumHCID 312ChlorideHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 16028TetrabutylammoniumHCID 28179Fluoride IonHCID 72312779{2-(3-Methoxy-5-triisopropylsilanyloxyphenyl)-2-[4-(5-methyl-[1,2,4]oxadiazol-3-yl)phenylimino]-1-methylsulfanylethylidene}carbamic acid methyl ester

생성물 1

HCID 72312820{2-(3-Hydroxy-5-methoxyphenyl)-2-[4-(5-methyl-[1,2,4]oxadiazol-3-yl)phenylimino]-1-methylsulfanylethylidene}carbamic acid methyl ester

출처 및 근거

ORD 기록
ord-11a55d2ef1b74937bf6b44b90a9c7365
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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