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Tetrahydrofuran → 1-(3-(6,7-dimethoxyquinazolin-4-ylthio)phenyl)-3-(3-isopropyl-1-(4-methoxyphenyl)-1H-pyrazol-5-yl)urea

HRID 1136137
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HRID 1136137 반응식
[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([S:15][c:16]3[cH:17][c:18]([NH2:19])[cH:20][cH:21][cH:22]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:54][N:55]([c:56]1[cH:57][cH:58][n:59][cH:60][cH:61]1)[CH3:62].[CH:23]([CH3:24])([CH3:25])[c:26]1[n:27][n:28](-[c:41]2[cH:42][cH:43][c:44]([O:47][CH3:48])[cH:45][cH:46]2)[c:29]([NH:31][C:32]([O:33][c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)=[O:34])[cH:30]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([S:15][c:16]3[cH:17][c:18]([NH:19][C:32]([NH:31][c:29]4[n:28](-[c:41]5[cH:42][cH:43][c:44]([O:47][CH3:48])[cH:45][cH:46]5)[n:27][c:26]([CH:23]([CH3:24])[CH3:25])[cH:30]4)=[O:33])[cH:20][cH:21][cH:22]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]
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참가 물질

5

반응물 4

HCID 8028TetrahydrofuranHCID 142844-(Dimethylamino)pyridineHCID 569536273-(6,7-Dimethoxyquinazolin-4-ylthio)anilineHCID 66876747phenyl 3-isopropyl-1-(4-methoxyphenyl)-1H-pyrazol-5-ylcarbamate

생성물 1

HCID 668768211-(3-(6,7-dimethoxyquinazolin-4-ylthio)phenyl)-3-(3-isopropyl-1-(4-methoxyphenyl)-1H-pyrazol-5-yl)urea

출처 및 근거

ORD 기록
ord-8574752938b14b67b431ff47291cb4f8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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