HRID1203835

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID962

Water

H2O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl Acetate

C4H8O2

HCID2758519

3-(Dimethylamino)pyrrolidine

C6H14N2

HCID68585884

未命名化合物

PRODUCTS

产物

HCID77526274

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-524f46d5b73d4241989af1db9dd09b6f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([F:19])[c:6]2[c:7]([n:8][c:9]([CH:11]3[CH2:12][CH2:13]3)[o:10]2)[c:14]([C:17]#[N:18])[c:15]1[CH3:16].[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:27][N:28]([CH:29]1[CH2:30][NH:31][CH2:32][CH2:33]1)[CH3:34].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[CH3:41][S:42](=[O:43])[CH3:44].[OH2:45]>>[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([N:31]2[CH2:30][CH:29]([N:28]([CH3:27])[CH3:34])[CH2:33][CH2:32]2)[c:6]2[c:7]([n:8][c:9]([CH:11]3[CH2:12][CH2:13]3)[o:10]2)[c:14]([C:17]#[N:18])[c:15]1[CH3:16]