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Triethylamine → 3-chloro-N-(3-(4-(1-(2-cyano-1-cyclopropylethyl)-1H-pyrazol-4-yl)-5-methoxypyrimidin-2-ylamino)phenyl)propane-1-sulfonamide

HRID 1549291
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반응식

HRID 1549291 반응식
[CH2:29]1[O:30][CH2:31][CH2:32][O:33][CH2:34]1.[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[Cl:42][CH2:43][CH2:44][CH2:45][S:46](=[O:47])(=[O:48])[Cl:49].[NH2:1][c:2]1[cH:3][c:4]([NH:8][c:9]2[n:10][cH:11][c:12]([O:27][CH3:28])[c:13](-[c:15]3[cH:16][n:17][n:18]([CH:20]([CH2:21][C:22]#[N:23])[CH:24]4[CH2:25][CH2:26]4)[cH:19]3)[n:14]2)[cH:5][cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][c:4]([NH:8][c:9]2[n:10][cH:11][c:12]([O:27][CH3:28])[c:13](-[c:15]3[cH:16][n:17][n:18]([CH:20]([CH2:21][C:22]#[N:23])[CH:24]4[CH2:25][CH2:26]4)[cH:19]3)[n:14]2)[cH:5][cH:6][cH:7]1)[S:46]([CH2:45][CH2:44][CH2:43][Cl:42])(=[O:47])=[O:48]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 8471TriethylamineHCID 154103-Chloropropanesulphonyl chlorideHCID 312751,4-DioxaneHCID 580145283-(4-{2-[(3-aminophenyl)amino]-5-methoxypyrimidin-4-yl}-1H-pyrazol-1-yl)-3-cyclopropylpropanenitrile

생성물 1

HCID 687551903-chloro-N-(3-(4-(1-(2-cyano-1-cyclopropylethyl)-1H-pyrazol-4-yl)-5-methoxypyrimidin-2-ylamino)phenyl)propane-1-sulfonamide

출처 및 근거

ORD 기록
ord-653d1613d9f748cebd98bcca470ebbe0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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