HRID173523

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

HCID1068

Dimethyl sulfide

C2H6S

HCID8028

Tetrahydrofuran

C4H8O

HCID28123

Tetrahydroborate

H4B-

HCID551090

未命名化合物

结构：O=C(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(OCc2ccccc2)cc1)c1ccc(F)cc1

HCID53394972

4-[4-(Benzyloxy)phenyl]-1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-oxopropyl]azetidin-2-one

C31H25F2NO3

PRODUCTS

生成物

结构：O=C1C(CCC(O)c2ccc(F)cc2)C(c2ccc(OCc3ccccc3)cc2)N1c1ccc(F)cc1

HCID53394945

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-83ff800b94524103b1c03a3b04da191e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[BH4-:62].[CH2:64]1[O:65][CH2:66][CH2:67][CH2:68]1.[CH3:1][B:2]1[N:3]2[CH2:4][CH2:5][CH2:6][CH:7]2[C:8]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[O:21]1.[CH3:59][S:60][CH3:61].[CH3:69][OH:70].[ClH:63].[F:22][c:23]1[cH:24][cH:25][c:26]([N:29]2[C:30](=[O:58])[CH:31]([CH2:47][CH2:48][C:49](=[O:50])[c:51]3[cH:52][cH:53][c:54]([F:57])[cH:55][cH:56]3)[CH:32]2[c:33]2[cH:34][cH:35][c:36]([O:39][CH2:40][c:41]3[cH:42][cH:43][cH:44][cH:45][cH:46]3)[cH:37][cH:38]2)[cH:27][cH:28]1>>[F:22][c:23]1[cH:24][cH:25][c:26]([N:29]2[C:30](=[O:58])[CH:31]([CH2:47][CH2:48][CH:49]([OH:50])[c:51]3[cH:52][cH:53][c:54]([F:57])[cH:55][cH:56]3)[CH:32]2[c:33]2[cH:34][cH:35][c:36]([O:39][CH2:40][c:41]3[cH:42][cH:43][cH:44][cH:45][cH:46]3)[cH:37][cH:38]2)[cH:27][cH:28]1