Chloroform → 5-diethylamino-2-(N'-n-butylureido)-N-[(1-diphenylmethylpiperidin-4-yl)methyl]benzamide

반응식

[CH2:36]([CH2:37][CH2:38][CH3:39])[N:40]=[C:41]=[O:42].[Cl:43][CH:44]([Cl:45])[Cl:46].[NH2:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][CH:8]2[CH2:9][CH2:10][N:11]([CH:14]([c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[CH2:12][CH2:13]2)[cH:27][c:28]([N:31]([CH2:32][CH3:33])[CH2:34][CH3:35])[cH:29][cH:30]1>>[NH:1]([c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][CH:8]2[CH2:9][CH2:10][N:11]([CH:14]([c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[CH2:12][CH2:13]2)[cH:27][c:28]([N:31]([CH2:32][CH3:33])[CH2:34][CH3:35])[cH:29][cH:30]1)[C:41]([NH:40][CH2:36][CH2:37][CH2:38][CH3:39])=[O:42]

참가 물질

반응물 3

HCID 6212Chloroform

HCID 8110Butyl isocyanate

HCID 675958752-amino-5-diethylamino-N-[(1-diphenylmethylpiperidin-4-yl)methyl]benzamide

생성물 1

HCID 99379445-diethylamino-2-(N'-n-butylureido)-N-[(1-diphenylmethylpiperidin-4-yl)methyl]benzamide

출처 및 근거

ORD 기록: ord-b8ee460efcb44d4da43cfc52c8b6c2f8
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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