Hydrochloric Acid → HCID 57474472, compound
Reaction equation
[CH3:18][NH2:19].[CH3:1][NH:2][CH2:3][CH2:4][CH2:5][n:6]1[cH:7][cH:8][c:9]2[cH:10][cH:11][c:12]([N+:15](=[O:16])[O-:17])[cH:13][c:14]12.[CH3:77][NH:78][CH2:79][CH2:80][CH2:81][n:82]1[c:83]2[c:84]([cH:85][cH:86][c:87]([NH:88][C:89]([c:90]3[s:91][cH:92][cH:93][cH:94]3)=[NH:95])[cH:96]2)[cH:97][cH:98]1.[ClH:47].[ClH:48].[ClH:75].[ClH:76].[IH:46].[O:20]1[CH2:21][CH2:22][N:23]([CH2:24][CH2:25][CH2:26][n:27]2[c:28]3[c:29]([cH:30][cH:31][c:32]([NH:33][C:34]([c:35]4[s:36][cH:37][cH:38][cH:39]4)=[NH:40])[cH:41]3)[cH:42][cH:43]2)[CH2:44][CH2:45]1.[O:49]1[CH2:50][CH2:51][N:52]([CH2:53][CH2:54][CH2:55][n:56]2[c:57]3[c:58]([cH:59][cH:60][c:61]([NH:62][C:63]([c:64]4[s:65][cH:66][cH:67][cH:68]4)=[NH:69])[cH:70]3)[cH:71][cH:72]2)[CH2:73][CH2:74]1>>[CH2:3]([CH2:4][CH2:5][n:6]1[cH:7][cH:8][c:9]2[cH:10][cH:11][c:12]([N+:15](=[O:16])[O-:17])[cH:13][c:14]12)[Cl:47]Participants
7
Sources & evidence
- ORD record
- ord-baf00ef77d0b40d8ba19842b748cb3de
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…