HRID42332

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COc1ccc(-c2ccc3nc(NCc4ccc(S(N)(=O)=O)cc4)nc(NC4(C(F)(F)F)CC4)c3n2)cc1S(C)(=O)=O

HCID44621695

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)c1cc(-c2ccc3nc(NCc4ccc(S(N)(=O)=O)cc4)nc(NC4(C(F)(F)F)CC4)c3n2)ccc1F

HCID58275318

未命名化合物

PROCEDURE

实验过程

4-{[6-(3-Methanesulfonyl-4-methyl-phenyl)-4-(1-trifluoromethyl-cyclopropylamino)-pyrido[3,2-d]pyrimidin-2-ylamino]-methyl}-benzenesulfonamide; 4-{[6-(3-Methanesulfonyl-4-methoxy-phenyl)-4-(1-trifluoromethyl-cyclopropylamino)-pyrido[3,2-d]pyrimidin-2-ylamino]-methyl}-benzenesulfonamide; 4-{[6-(4-Chloro-3-methanesulfonyl-phenyl)-4-(1-trifluoromethyl-cyclopropylamino)-pyrido[3,2-d]pyrimidin-2-ylamino]-methyl}-benzenesulfonamide; 4-{[6-(3-Cyclopropanesulfonyl-4-methoxy-phenyl)-4-(1-trifluoromethyl-cyclopropylamino)-pyrido[3,2-d]pyrimidin-2-ylamino]-methyl}-benzenesulfonamide; 6-(3-Methanesulfonyl-4-methoxy-phenyl)-N2-[1-(4-[1,2,4]triazol-1-yl-phenyl)-ethyl]-N4-(1-trifluoromethyl-cyclopropyl)-pyrido[3,2-d]pyrimidine-2,4-diamine

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7d0b559f529e477abb6d5b62bd48efc9
来源数据集: uspto-grants-2013_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08536187B2
来源说明: uspto-grants-2013_09

反应 SMILES

[CH3:1][S:2]([C:5]1[CH:6]=[C:7]([C:12]2[CH:13]=[CH:14][C:15]3[N:16]=[C:17]([NH:30][CH2:31][C:32]4[CH:37]=[CH:36][C:35]([S:38]([NH2:41])(=[O:40])=[O:39])=[CH:34][CH:33]=4)[N:18]=[C:19]([NH:22][C:23]4([C:26]([F:29])([F:28])[F:27])[CH2:25][CH2:24]4)[C:20]=3[N:21]=2)[CH:8]=[CH:9][C:10]=1C)(=[O:4])=[O:3].CS(C1C=C(C2C=CC3N=C(NCC4C=CC(S(N)(=O)=O)=CC=4)N=C(NC4(C(F)(F)[F:69])CC4)C=3N=2)C=CC=1OC)(=O)=O.ClC1C=CC(C2C=CC3N=C(NCC4C=CC(S(N)(=O)=O)=CC=4)N=C(NC4(C(F)(F)F)CC4)C=3N=2)=CC=1S(C)(=O)=O.C1(S(C2C=C(C3C=CC4N=C(NCC5C=CC(S(N)(=O)=O)=CC=5)N=C(NC5(C(F)(F)F)CC5)C=4N=3)C=CC=2OC)(=O)=O)CC1.CS(C1C=C(C2C=CC3N=C(NC(C4C=CC(N5C=NC=N5)=CC=4)C)N=C(NC4(C(F)(F)F)CC4)C=3N=2)C=CC=1OC)(=O)=O>>[F:69][C:10]1[CH:9]=[CH:8][C:7]([C:12]2[CH:13]=[CH:14][C:15]3[N:16]=[C:17]([NH:30][CH2:31][C:32]4[CH:37]=[CH:36][C:35]([S:38]([NH2:41])(=[O:40])=[O:39])=[CH:34][CH:33]=4)[N:18]=[C:19]([NH:22][C:23]4([C:26]([F:28])([F:29])[F:27])[CH2:25][CH2:24]4)[C:20]=3[N:21]=2)=[CH:6][C:5]=1[S:2]([CH3:1])(=[O:4])=[O:3]