tert-Butyl isocyanate → 3-Tert-butyl-1-[6-(2,6-dichlorophenyl)-2-{[3-(dimethylamino)propyl]amino}pyrido[2,3-d]pyrimidin-7-yl]urea

HRID 694627

반응식

HRID 694627 반응식
[C:27]([CH3:28])([CH3:29])([CH3:30])[N:31]=[C:32]=[O:33].[NH2:1][c:2]1[c:3](-[c:19]2[c:20]([Cl:26])[cH:21][cH:22][cH:23][c:24]2[Cl:25])[cH:4][c:5]2[c:6]([n:7][c:8]([NH:11][CH2:12][CH2:13][CH2:14][N:15]([CH3:16])[CH3:17])[n:9][cH:10]2)[n:18]1>>[NH:1]([c:2]1[c:3](-[c:19]2[c:20]([Cl:26])[cH:21][cH:22][cH:23][c:24]2[Cl:25])[cH:4][c:5]2[c:6]([n:7][c:8]([NH:11][CH2:12][CH2:13][CH2:14][N:15]([CH3:16])[CH3:17])[n:9][cH:10]2)[n:18]1)[C:32]([NH:31][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:33]

참가 물질

3

반응물 2

HCID 62412tert-Butyl isocyanateHCID 53281386-(2,6-dichlorophenyl)-2-N-[3-(dimethylamino)propyl]pyrido[2,3-d]pyrimidine-2,7-diamine

생성물 1

HCID 53281393-Tert-butyl-1-[6-(2,6-dichlorophenyl)-2-{[3-(dimethylamino)propyl]amino}pyrido[2,3-d]pyrimidin-7-yl]urea

출처 및 근거

ORD 기록
ord-8516aeea1645495a82ee44306b1d5a2c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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