Cyanide → HCID 10391894, compound
Reaction equation
[C-:121]#[N:122].[C-:124]#[N:125].[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[I:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[cH:9][c:10]([NH:15][c:16]3[n:17][cH:18][cH:19][c:20](-[c:22]4[cH:23][n:24][cH:25][cH:26][cH:27]4)[n:21]3)[c:11]([CH3:14])[cH:12][cH:13]2)[cH:28][cH:29][c:30]1[CH2:31][N:32]1[CH2:33][CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]1.[Zn+2:123].[cH:44]1[cH:45][cH:46][c:47]([P:48]([Pd:49]([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)([c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[cH:119][cH:120]1>>[c:2]1([C:39]#[N:40])[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[cH:9][c:10]([NH:15][c:16]3[n:17][cH:18][cH:19][c:20](-[c:22]4[cH:23][n:24][cH:25][cH:26][cH:27]4)[n:21]3)[c:11]([CH3:14])[cH:12][cH:13]2)[cH:28][cH:29][c:30]1[CH2:31][N:32]1[CH2:33][CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]1Participants
6
Sources & evidence
- ORD record
- ord-fdd135ddd97a4e0e92ead2c4dd5ae757
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…