tert-Butyl isocyanate → 1-[2-Amino-6-(2,3-dimethylphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3-tert-butylurea

반응식

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

참가 물질

반응물 2

HCID 62412tert-Butyl isocyanate

HCID 218500186-(2,3-Dimethyl-phenyl)-pyrido[2,3-d]pyrimidine-2,7-diamine

생성물 1

HCID 53291201-[2-Amino-6-(2,3-dimethylphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3-tert-butylurea

출처 및 근거

ORD 기록: ord-fd8d1c55b0d64e6f862e987315573c22
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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