HRID806968

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID8471

Triethylamine

C6H15N

HCID18502

Isocyanatocyclohexane

C7H11NO

HCID102208

Phenol, 4-isothiocyanato-

C7H5NOS

HCID4149208

Dodecanoate anion

C12H23O2-

2 次

HCID9543249

Dibutyltin ion

C8H18Sn+2

PRODUCTS

生成物

HCID21489003

4-Isothiocyanatophenyl cyclohexylcarbamate

C14H16N2O2S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3f1a376315ee4531bca0369cbd24ceee
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

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