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Dimethylformamide → 2-{1-[6-(3-cyano-5-methyl-benzoyl)-5-isopropyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-ylmethyl]-cyclopropyl}-N-(4-methoxy-benzyl)-acetamide

HRID 1575724
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HRID 1575724 반응식
[C:1](#[N:2])[c:3]1[cH:4][c:5]([C:6](=[O:7])[c:8]2[c:9]([CH:24]([CH3:25])[CH3:26])[c:10](=[O:23])[nH:11][c:12](=[O:22])[n:13]2[CH2:14][C:15]2([CH2:18][C:19](=[O:20])[OH:21])[CH2:16][CH2:17]2)[cH:27][c:28]([CH3:30])[cH:29]1.[CH2:52]1[O:53][CH2:54][CH2:55][CH2:56]1.[CH3:42][O:43][c:44]1[cH:45][cH:46][c:47]([CH2:48][NH2:49])[cH:50][cH:51]1.[Cl:31][C:32]([C:33]([Cl:34])=[O:35])=[O:36].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([C:6](=[O:7])[c:8]2[c:9]([CH:24]([CH3:25])[CH3:26])[c:10](=[O:23])[nH:11][c:12](=[O:22])[n:13]2[CH2:14][C:15]2([CH2:18][C:19](=[O:20])[NH:49][CH2:48][c:47]3[cH:46][cH:45][c:44]([O:43][CH3:42])[cH:51][cH:50]3)[CH2:16][CH2:17]2)[cH:27][c:28]([CH3:30])[cH:29]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 65578Oxalyl chlorideHCID 754524-MethoxybenzylamineHCID 25215194{1-[6-(3-cyano-5-methyl-benzoyl)-5-isopropyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-ylmethyl]-cyclopropyl}-acetic acid

생성물 1

HCID 58203468
2-{1-[6-(3-cyano-5-methyl-benzoyl)-5-isopropyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-ylmethyl]-cyclopropyl}-N-(4-methoxy-benzyl)-acetamide

출처 및 근거

ORD 기록
ord-adbefeb48427432d92dc2b9353711f33
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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