HRID300655

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID887

Methanol

CH4O

HCID30856

Mercuric oxide

HgO

反应SMILES：CCCCCCNC(=S)Nc1ccc(-c2cccc(S(=O)(=O)c3cc(C(=N)NC(=O)OC(C)(C)C)sc3SC)c2)c(C)c1

HCID145857629

未命名化合物

PRODUCTS

产物

反应SMILES：CCCCCCN=C(N)Nc1ccc(-c2cccc(S(=O)(=O)c3cc(C(=N)NC(=O)OC(C)(C)C)sc3SC)c2)c(C)c1

HCID140043493

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-aaa6274476ff4ada8ba784ed36476916
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8](=[NH:9])[c:10]1[s:11][c:12]([S:41][CH3:42])[c:13]([S:15](=[O:16])(=[O:17])[c:18]2[cH:19][c:20](-[c:24]3[c:25]([CH3:40])[cH:26][c:27]([NH:30][C:31](=[S:32])[NH:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[cH:28][cH:29]3)[cH:21][cH:22][cH:23]2)[cH:14]1)=[O:43].[CH3:45][OH:46].[Hg:47]=[O:48].[NH3:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8](=[NH:9])[c:10]1[s:11][c:12]([S:41][CH3:42])[c:13]([S:15](=[O:16])(=[O:17])[c:18]2[cH:19][c:20](-[c:24]3[c:25]([CH3:40])[cH:26][c:27]([NH:30][C:31](=[N:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[NH2:44])[cH:28][cH:29]3)[cH:21][cH:22][cH:23]2)[cH:14]1)=[O:43]