HRID824887

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID18618342

未命名化合物

结构：O=C(O)C1CC(SC(c2ccccc2)(c2ccccc2)c2ccccc2)CN1S(=O)(=O)c1ccc2ccccc2c1

HCID22671562

未命名化合物

PRODUCTS

生成物

结构：N#CCCn1nnnc1C(Cc1ccc(-c2ccccc2)cc1)NC(=O)C1CC(SC(c2ccccc2)(c2ccccc2)c2ccccc2)CN1S(=O)(=O)c1ccc2ccccc2c1

HCID178511109

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f68643da237d40be990c48ecb38b3208
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:87]1[O:88][CH2:89][CH2:90][CH2:91]1.[CH3:66][CH2:67][N:68]=[C:69]=[N:70][CH2:71][CH2:72][CH2:73][N:74]([CH3:75])[CH3:76].[NH2:42][CH:43]([CH2:44][c:45]1[cH:46][cH:47][c:48](-[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[cH:49][cH:50]1)[c:57]1[n:58][n:59][n:60][n:61]1[CH2:62][CH2:63][C:64]#[N:65].[OH:77][n:78]1[c:79]2[c:80]([cH:81][cH:82][cH:83][cH:84]2)[n:85][n:86]1.[cH:1]1[c:2]([S:11](=[O:12])(=[O:13])[N:14]2[CH:15]([C:39](=[O:40])[OH:41])[CH2:16][CH:17]([S:19][C:20]([c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)([c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[CH2:18]2)[cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[cH:1]1[c:2]([S:11](=[O:12])(=[O:13])[N:14]2[CH:15]([C:39](=[O:40])[NH:42][CH:43]([CH2:44][c:45]3[cH:46][cH:47][c:48](-[c:51]4[cH:52][cH:53][cH:54][cH:55][cH:56]4)[cH:49][cH:50]3)[c:57]3[n:58][n:59][n:60][n:61]3[CH2:62][CH2:63][C:64]#[N:65])[CH2:16][CH:17]([S:19][C:20]([c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)([c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[CH2:18]2)[cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12