Cyanide → HCID 46701122, compound
Reaction equation
[C-:41]#[N:42].[C-:44]#[N:45].[CH3:102][N:103]1[CH2:104][CH2:105][CH2:106][C:107]1=[O:108].[CH3:33][N:34]([CH3:35])[CH2:36][CH2:37][N:38]([CH3:39])[CH3:40].[Cl:1][c:2]1[c:3]([F:32])[cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]3[c:16]([cH:17]2)[CH2:15][N:14]([c:18]2[n:19][c:20]([NH2:31])[n:21][c:22]([N:24]4[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]4)[cH:23]2)[CH2:13][CH2:12]3)[cH:6][n:7]1.[O:48]=[C:49]([CH:50]=[CH:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1)[CH:58]=[CH:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[O:66]=[C:67]([CH:68]=[CH:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1)[CH:76]=[CH:77][c:78]1[cH:79][cH:80][cH:81][cH:82][cH:83]1.[O:84]=[C:85]([CH:86]=[CH:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1)[CH:94]=[CH:95][c:96]1[cH:97][cH:98][cH:99][cH:100][cH:101]1.[Pd:46].[Pd:47].[Zn+2:43]>>[c:2]1([C:33]#[N:34])[c:3]([F:32])[cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]3[c:16]([cH:17]2)[CH2:15][N:14]([c:18]2[n:19][c:20]([NH2:31])[n:21][c:22]([N:24]4[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]4)[cH:23]2)[CH2:13][CH2:12]3)[cH:6][n:7]1Participants
8
Sources & evidence
- ORD record
- ord-a3189bfe8541473a83dcd70f17657267
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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