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Hydrochloric Acid → N-[5-(3,5-difluoro-benzyloxy)-1H-indazol-3-yl]-4-[(3-dimethylamino-propyl)-methyl-amino]-2-nitro-benzamide

HRID 945425
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인쇄 미리보기

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HRID 945425 반응식
[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[CH3:2][N:3]([CH2:4][CH2:5][CH2:6][N:7]([c:8]1[cH:9][c:10]([N+:17](=[O:18])[O-:19])[c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16]1)[CH3:20])[CH3:21].[ClH:1].[F:31][c:32]1[cH:33][c:34]([CH2:35][O:36][c:37]2[cH:38][c:39]3[c:40]([NH2:46])[n:41][nH:42][c:43]3[cH:44][cH:45]2)[cH:47][c:48]([F:50])[cH:49]1.[O:22]=[CH:23][N:24]([CH3:25])[CH3:26].[S:27]([Cl:28])([Cl:29])=[O:30].[cH:56]1[cH:57][cH:58][n:59][cH:60][cH:61]1>>[CH3:2][N:3]([CH2:4][CH2:5][CH2:6][N:7]([c:8]1[cH:9][c:10]([N+:17](=[O:18])[O-:19])[c:11]([C:12](=[O:14])[NH:46][c:40]2[c:39]3[cH:38][c:37]([O:36][CH2:35][c:34]4[cH:33][c:32]([F:31])[cH:49][c:48]([F:50])[cH:47]4)[cH:45][cH:44][c:43]3[nH:42][n:41]2)[cH:15][cH:16]1)[CH3:20])[CH3:21]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 1049PyridineHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 24386Thionyl ChlorideHCID 667370154-[3-(Dimethylamino)propyl-methylamino]-2-nitrobenzoic acidHCID 669970485-[(3,5-difluorobenzyl)oxy]-1H-indazol-3-amine

생성물 1

HCID 46244493N-[5-(3,5-difluoro-benzyloxy)-1H-indazol-3-yl]-4-[(3-dimethylamino-propyl)-methyl-amino]-2-nitro-benzamide

출처 및 근거

ORD 기록
ord-1381aae8fba645448b8e007f4b282fbc
출처 데이터셋
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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