3-(Pyrrolidin-1-yl)aniline → 2-[(2-aminocyclohexyl)amino]-4-(3-pyrrolidin-1-ylanilino)pyrimidine-5-carboxamide

반응식

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

참가 물질

반응물 2

HCID 15188083-(Pyrrolidin-1-yl)aniline

HCID 178513748HCID 178513748, 화합물

생성물 1

HCID 1785137502-[(2-aminocyclohexyl)amino]-4-(3-pyrrolidin-1-ylanilino)pyrimidine-5-carboxamide

출처 및 근거

ORD 기록: ord-7786abd65d3f40bca43519e2fa1426f8
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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