HRID96473

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl Acetate

C4H8O2

HCID3268011

tert-Butyl (2-aminocyclohexyl)carbamate

C11H22N2O2

HCID58317650

未命名化合物

PRODUCTS

产物

HCID77253079

methyl 4-cyano-2-(1H-indazol-6-ylamino)-6-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]amino]pyridine-3-carboxylate

C26H31N7O4

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-76df496c522944d3b4d08939292e78fe
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[NH2:24][CH:25]1[CH:26]([NH:31][C:32]([O:33][C:34]([CH3:35])([CH3:36])[CH3:37])=[O:38])[CH2:27][CH2:28][CH2:29][CH2:30]1.[OH2:46].[nH:1]1[n:2][cH:3][c:4]2[cH:5][cH:6][c:7]([NH:10][c:11]3[c:12]([C:13](=[O:14])[O:15][CH3:16])[c:17]([C:22]#[N:23])[cH:18][c:19]([Cl:21])[n:20]3)[cH:8][c:9]12>>[nH:1]1[n:2][cH:3][c:4]2[cH:5][cH:6][c:7]([NH:10][c:11]3[c:12]([C:13](=[O:14])[O:15][CH3:16])[c:17]([C:22]#[N:23])[cH:18][c:19]([NH:24][CH:25]4[CH:26]([NH:31][C:32]([O:33][C:34]([CH3:35])([CH3:36])[CH3:37])=[O:38])[CH2:27][CH2:28][CH2:29][CH2:30]4)[n:20]3)[cH:8][c:9]12