2,4-Dimethoxyphenyl isocyanate → 1-(2,4-Dimethoxyphenyl)-3-[4-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)phenyl]-urea

HRID 2125746

반응식

HRID 2125746 반응식
[CH3:26][O:27][c:28]1[c:29]([N:36]=[C:37]=[O:38])[cH:30][cH:31][c:32]([O:34][CH3:35])[cH:33]1.[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[n:8][c:9](-[c:19]3[cH:20][cH:21][c:22]([NH2:23])[cH:24][cH:25]3)[n:10][c:11]([N:13]3[CH2:14][CH2:15][O:16][CH2:17][CH2:18]3)[n:12]2)[CH2:5][CH2:6]1>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[n:8][c:9](-[c:19]3[cH:20][cH:21][c:22]([NH:23][C:37]([NH:36][c:29]4[c:28]([O:27][CH3:26])[cH:33][c:32]([O:34][CH3:35])[cH:31][cH:30]4)=[O:38])[cH:24][cH:25]3)[n:10][c:11]([N:13]3[CH2:14][CH2:15][O:16][CH2:17][CH2:18]3)[n:12]2)[CH2:5][CH2:6]1

참가 물질

3

반응물 2

HCID 6016372,4-Dimethoxyphenyl isocyanateHCID 453790874-(4,6-Dimorpholino-1,3,5-triazin-2-yl)aniline

생성물 1

HCID 445142021-(2,4-Dimethoxyphenyl)-3-[4-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)phenyl]-urea

출처 및 근거

ORD 기록
ord-d20cd92a2f8d4adba41cbc1d99dc7f86
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

연결된 노트

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