HRID160785

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

HCID5174955

2-(2,3-dihydro-1H-inden-2-yl)acetic Acid

C11H12O2

结构：NC(C(=O)Nc1cc2c3c(c(-c4ccccc4)[nH]c3c1)C=NNC2=O)C1CCCCC1

HCID135475361

未命名化合物

PRODUCTS

生成物

结构：O=C(CC1Cc2ccccc2C1)Nc1cc2c3c(c(-c4ccccc4)[nH]c3c1)C=NNC2=O

HCID135507243

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-50575f28496544328e1d7effc32233ce
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

[CH2:32]1[CH:33]([CH2:41][C:42](=[O:43])[OH:44])[CH2:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]21.[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[CH3:79][N:80]([CH3:81])[CH:82]=[O:83].[Cl:76][CH2:77][Cl:78].[NH2:1][CH:2]([CH:3]1[CH2:4][CH2:26][CH2:27][CH2:28][CH2:29]1)[C:30]([NH:5][c:6]1[cH:7][c:8]2[c:9]3[c:10]([c:11](-[c:15]4[cH:16][cH:17][cH:18][cH:19][cH:20]4)[nH:12][c:13]3[cH:14]1)[cH:21][n:22][nH:23][c:24]2=[O:25])=[O:31].[P-:52]([F:53])([F:54])([F:55])([F:56])([F:57])[F:58].[n:59]1([O:60][C:61]([N:62]([CH3:63])[CH3:64])=[N+:65]([CH3:66])[CH3:67])[c:68]2[n:69][cH:70][cH:71][cH:72][c:73]2[n:74][n:75]1>>[NH:5]([c:6]1[cH:7][c:8]2[c:9]3[c:10]([c:11](-[c:15]4[cH:16][cH:17][cH:18][cH:19][cH:20]4)[nH:12][c:13]3[cH:14]1)[cH:21][n:22][nH:23][c:24]2=[O:25])[C:42]([CH2:41][CH:33]1[CH2:32][c:40]2[c:35]([cH:36][cH:37][cH:38][cH:39]2)[CH2:34]1)=[O:44]