Acetonitrile → tert-butyl 4-(2-(2-oxo-2,3-dihydro-1H-benzo[d]imidazol-5-ylamino) quinazolin-7-yloxy)piperidine-1-carboxylate

HRID 313489

반응식

HRID 313489 반응식
[CH2:1]([S:2](=[O:3])(=[O:4])[c:6]1[n:7][c:8]2[cH:9][c:10]([O:16][CH:17]3[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]3)[cH:11][cH:12][c:13]2[cH:14][n:15]1)[CH3:5].[CH3:41][C:42]#[N:43].[NH2:30][c:31]1[cH:32][c:33]2[c:34]([nH:35][c:36](=[O:38])[nH:37]2)[cH:39][cH:40]1>>[c:6]1([NH:30][c:31]2[cH:32][c:33]3[c:34]([nH:35][c:36](=[O:38])[nH:37]3)[cH:39][cH:40]2)[n:7][c:8]2[cH:9][c:10]([O:16][CH:17]3[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]3)[cH:11][cH:12][c:13]2[cH:14][n:15]1

참가 물질

4

반응물 3

HCID 6342AcetonitrileHCID 667655-Amino-2-hydroxybenzimidazoleHCID 67102269Tert-butyl 4-(2-(ethylsulfonyl) quinazolin-7-yloxy)piperidine-1-carboxylate

생성물 1

HCID 67102611tert-butyl 4-(2-(2-oxo-2,3-dihydro-1H-benzo[d]imidazol-5-ylamino) quinazolin-7-yloxy)piperidine-1-carboxylate

출처 및 근거

ORD 기록
ord-cea1851a56124f498ca8132cdba2c73a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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