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Hydrochloric Acid → HCID 46918205, 화합물

HRID 95148
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HRID 95148 반응식
[CH2:56]1[O:57][CH2:58][CH2:59][O:60][CH2:61]1.[CH:39]12[CH2:40][NH2+:41][CH2:42][CH:43]([CH2:44][CH2:45]1)[O:46]2.[CH:47]([N:48]([CH2:49][CH3:50])[CH:51]([CH3:52])[CH3:53])([CH3:54])[CH3:55].[ClH:38].[F:1][CH:2]([c:3]1[n:4][c:5]2[c:6]([n:7]1-[c:8]1[n:9][c:10]([N:20]3[CH2:21][CH2:22][N:23]([S:26](=[O:27])(=[O:28])[CH:29]=[CH2:30])[CH2:24][CH2:25]3)[n:11][c:12]([N:14]3[CH2:15][CH2:16][O:17][CH2:18][CH2:19]3)[n:13]1)[cH:31][cH:32][cH:33][c:34]2[O:35][CH3:36])[F:37]>>[F:1][CH:2]([c:3]1[n:4][c:5]2[c:6]([n:7]1-[c:8]1[n:9][c:10]([N:20]3[CH2:21][CH2:22][N:23]([S:26](=[O:27])(=[O:28])[CH2:29][CH2:30][N:41]4[CH2:40][CH:39]5[CH2:45][CH2:44][CH:43]([CH2:42]4)[O:46]5)[CH2:24][CH2:25]3)[n:11][c:12]([N:14]3[CH2:15][CH2:16][O:17][CH2:18][CH2:19]3)[n:13]1)[cH:31][cH:32][cH:33][c:34]2[O:35][CH3:36])[F:37]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 81531DiisopropylethylamineHCID 469174972-(difluoromethyl)-4-methoxy-1-{4-(4-morpholinyl)-6-[4-(vinylsulfonyl)-1-piperazinyl]-1,3,5-triazin-2-yl}-1H-benzimidazoleHCID 756846018-Oxa-3-azoniabicyclo[3.2.1]octane

생성물 1

HCID 46918205
HCID 46918205, 화합물

출처 및 근거

ORD 기록
ord-3e726ef6332b4948886db456eecd68d7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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