HRID465665

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID75047

Isothiocyanic acid, p-dimethylaminophenyl ester

C9H10N2S

结构：CC(C)c1cccc(C(C)C)c1NC(=O)CNC(c1ccccc1)c1ccccc1

HCID1645639

未命名化合物

结构：CC(C)c1cccc(C(C)C)c1NC(=O)CNCC(c1ccccc1)c1ccccc1

HCID19874997

未命名化合物

PRODUCTS

生成物

结构：CCc1cccc(CC)c1NC(=O)CN(C(=S)Nc1ccc(N(C)C)cc1)C(c1ccccc1)c1ccccc1

HCID19874867

未命名化合物

PROCEDURE

实验过程

When in the procedure of Example 80 an appropriate amount of 4-dimethylaminophenylisothiocyanate was substituted for ethyl isocyanato acetate and an appropriate amount of the product of Example 4 was substituted for the product of Example 70 and the general procedure of Example 80 was followed the title compound was obtained. Total yield, 0.68 g (62%).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2c9899b9226d41c5bb67574309d31e3a
来源数据集: uspto-grants-1992_10
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05153226
来源说明: uspto-grants-1992_10

反应 SMILES

[CH3:1][N:2]([CH3:12])[C:3]1[CH:8]=[CH:7][C:6]([N:9]=[C:10]=[S:11])=[CH:5][CH:4]=1.[CH3:13][CH:14]([C:16]1[CH:21]=[CH:20][CH:19]=[C:18]([CH:22](C)[CH3:23])[C:17]=1[NH:25][C:26](=[O:42])[CH2:27][NH:28][CH:29]([C:36]1[CH:41]=[CH:40][CH:39]=[CH:38][CH:37]=1)[C:30]1[CH:35]=[CH:34][CH:33]=[CH:32][CH:31]=1)C.CC(C1C=CC=C(C(C)C)C=1NC(=O)CNCC(C1C=CC=CC=1)C1C=CC=CC=1)C>>[CH2:22]([C:18]1[CH:19]=[CH:20][CH:21]=[C:16]([CH2:14][CH3:13])[C:17]=1[NH:25][C:26](=[O:42])[CH2:27][N:28]([C:10]([NH:9][C:6]1[CH:7]=[CH:8][C:3]([N:2]([CH3:12])[CH3:1])=[CH:4][CH:5]=1)=[S:11])[CH:29]([C:30]1[CH:35]=[CH:34][CH:33]=[CH:32][CH:31]=1)[C:36]1[CH:37]=[CH:38][CH:39]=[CH:40][CH:41]=1)[CH3:23]