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Dimethylformamide → 4-Fluoro-N-[4-methoxy-7-(tetrahydro-pyran-2-yl)-benzothiazol-2-yl]-benzamide

HRID 2318068
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HRID 2318068 반응식
[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:35][O:36][c:37]1[cH:38][cH:39][c:40]([CH:47]2[O:48][CH2:49][CH2:50][CH2:51][CH2:52]2)[c:41]2[c:42]1[n:43][c:44]([NH2:46])[s:45]2.[O:58]1[CH2:59][CH2:60][O:61][CH2:62][CH2:63]1.[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][c:7]([F:8])[cH:9][cH:10]1.[P-:11]([F:12])([F:13])([F:14])([F:15])([F:16])[F:17].[n:18]1([O:19][C:20]([N:21]([CH3:22])[CH3:23])=[N+:24]([CH3:25])[CH3:26])[c:27]2[n:28][cH:29][cH:30][cH:31][c:32]2[n:33][n:34]1>>[C:2](=[O:3])([c:4]1[cH:5][cH:6][c:7]([F:8])[cH:9][cH:10]1)[NH:46][c:44]1[n:43][c:42]2[c:37]([O:36][CH3:35])[cH:38][cH:39][c:40]([CH:47]3[O:48][CH2:49][CH2:50][CH2:51][CH2:52]3)[c:41]2[s:45]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 9886HexafluorophosphateHCID 99734-Fluorobenzoic AcidHCID 312751,4-DioxaneHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 22719534
4-Methoxy-7-(tetrahydro-pyran-2-yl)-benzothiazol-2-ylamine

생성물 1

HCID 101727744-Fluoro-N-[4-methoxy-7-(tetrahydro-pyran-2-yl)-benzothiazol-2-yl]-benzamide

출처 및 근거

ORD 기록
ord-723d81aeb16b4a198f36081d39a0c202
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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