HRID152778

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

结构：O=C(O)C(=O)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1

HCID11133448

(2-tritylaminothiazol-4-yl)glyoxylic acid

C24H18N2O3S

结构：NOCc1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1

HCID21285079

未命名化合物

PRODUCTS

生成物

结构：O=C(O)C(=NOCc1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1

HCID54569817

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3d9270d0e137482f9ebaa2e86da56574
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

[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][c:21]1[s:22][cH:23][c:24]([C:26]([C:27](=[O:28])[OH:29])=[O:30])[n:25]1.[C:31]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)([c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1)([c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1)[NH:50][c:51]1[s:52][cH:53][c:54]([CH2:56][O:57][NH2:58])[n:55]1.[CH3:59][OH:60]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][c:21]1[s:22][cH:23][c:24]([C:26]([C:27](=[O:28])[OH:29])=[N:58][O:57][CH2:56][c:54]2[cH:53][s:52][c:51]([NH:50][C:31]([c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)([c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[c:44]3[cH:45][cH:46][cH:47][cH:48][cH:49]3)[n:55]2)[n:25]1