Dimethylformamide → Isopropyl 2-chloro-4-fluoro-5-{3-[2-(ethoxycarbonyl)-1-methyl-1-butenyl]ureido}-benzoate

반응식

[CH3:29][N:30]([CH3:31])[CH:32]=[O:33].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH:7]([CH3:8])[CH3:9])[cH:10][c:11]([N:15]=[C:16]=[O:17])[c:12]([F:14])[cH:13]1.[NH2:18][C:19](=[C:20]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[CH2:26][CH3:27])[CH3:28]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH:7]([CH3:8])[CH3:9])[cH:10][c:11]([NH:15][C:16](=[O:17])[NH:18][C:19](=[C:20]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[CH2:26][CH3:27])[CH3:28])[c:12]([F:14])[cH:13]1

참가 물질

반응물 3

HCID 6228Dimethylformamide

HCID 13519895Isopropyl 2-chloro-4-fluoro-5-isocyanatobenzoate

HCID 71438449Ethyl 3-amino-2-ethylbut-2-enoate

생성물 1

HCID 54032414Isopropyl 2-chloro-4-fluoro-5-{3-[2-(ethoxycarbonyl)-1-methyl-1-butenyl]ureido}-benzoate

출처 및 근거

ORD 기록: ord-1726e16a41c04256b1a3948c3d7897e1
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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