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Hydrochloric Acid → 4-(3-Acetoxy-4-methylanilino)-6-methoxy-7-((1-methylbenzimidazol-2-yl)methoxy)quinazoline

HRID 289324
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HRID 289324 반응식
[C:27](=[O:28])([O-:29])[O-:30].[C:2]([CH3:3])(=[O:4])[O:5][c:6]1[cH:7][c:8]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]3[cH:15][c:16]([OH:22])[c:17]([O:20][CH3:21])[cH:18][c:19]23)[cH:23][cH:24][c:25]1[CH3:26].[Cl:35][CH2:36][c:37]1[n:38][c:39]2[c:40]([n:41]1[CH3:42])[cH:43][cH:44][cH:45][cH:46]2.[ClH:1].[I-:34].[K+:31].[K+:32].[K+:33].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51]>>[C:2]([CH3:3])(=[O:4])[O:5][c:6]1[cH:7][c:8]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]3[cH:15][c:16]([O:22][CH2:36][c:37]4[n:38][c:39]5[c:40]([n:41]4[CH3:42])[cH:43][cH:44][cH:45][cH:46]5)[c:17]([O:20][CH3:21])[cH:18][c:19]23)[cH:23][cH:24][c:25]1[CH3:26]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 813Potassium Cation3회HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 30165Iodide IonHCID 2480442-(Chloromethyl)-1-methylbenzimidazoleHCID 1354508044-(3-Acetoxy-4-methylanilino)-7-hydroxy-6-methoxyquinazoline

생성물 1

HCID 226249724-(3-Acetoxy-4-methylanilino)-6-methoxy-7-((1-methylbenzimidazol-2-yl)methoxy)quinazoline

출처 및 근거

ORD 기록
ord-0c03da5e91a64de2b607cc926eb9dc1b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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