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Dimethylformamide → 3-[3-(6-Amino-5-benzothiazol-2-ylpyridin-3-yl)-prop-2-ynyl]-1,1-dimethylurea

HRID 1204332
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HRID 1204332 반응식
[CH3:21][N:22]([C:23](=[O:24])[Cl:25])[CH3:26].[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[NH2:1][CH2:2][C:3]#[C:4][c:5]1[cH:6][c:7](-[c:12]2[s:13][c:14]3[c:15]([n:16]2)[cH:17][cH:18][cH:19][cH:20]3)[c:8]([NH2:11])[n:9][cH:10]1.[O:27]=[CH:28][N:29]([CH3:30])[CH3:31]>>[NH:1]([CH2:2][C:3]#[C:4][c:5]1[cH:6][c:7](-[c:12]2[s:13][c:14]3[c:15]([n:16]2)[cH:17][cH:18][cH:19][cH:20]3)[c:8]([NH2:11])[n:9][cH:10]1)[C:23]([N:22]([CH3:21])[CH3:26])=[O:24]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 6228DimethylformamideHCID 6598Dimethylcarbamoyl ChlorideHCID 81531DiisopropylethylamineHCID 675208705-(3-Aminoprop-1-ynyl)-3-benzothiazol-2-ylpyridin-2-ylamine

생성물 1

HCID 675209823-[3-(6-Amino-5-benzothiazol-2-ylpyridin-3-yl)-prop-2-ynyl]-1,1-dimethylurea

출처 및 근거

ORD 기록
ord-8ebd1a08135245728082682d437b7ff1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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