6-[(2-aminoethyl)(methylsulfonyl)amino]-2-(4-bromophenyl)-5-cyclopropyl-N-methyl-2H-indazole-3-carboxamide → HCID 67513022, compound
Reaction equation
[CH:1]1([c:4]2[cH:5][c:6]3[c:7]([C:46](=[O:47])[NH:48][CH3:49])[n:8](-[c:32]4[cH:33][cH:34][c:35]([NH:38][c:39]5[cH:40][cH:41][c:42]([F:45])[cH:43][cH:44]5)[cH:36][cH:37]4)[n:9][c:10]3[cH:11][c:12]2[N:13]([S:14](=[O:15])(=[O:16])[CH3:17])[CH2:18][CH2:19][CH2:20][N:21]2[C:22](=[O:23])[c:24]3[c:25]([cH:26][cH:27][cH:28][cH:29]3)[C:30]2=[O:31])[CH2:2][CH2:3]1.[NH2:50][CH2:51][CH2:52][N:53]([S:54]([CH3:55])(=[O:56])=[O:57])[c:58]1[c:59]([CH:60]2[CH2:61][CH2:62]2)[cH:63][c:64]2[c:65]([cH:66]1)[n:67][n:68](-[c:69]1[cH:70][cH:71][c:72]([Br:73])[cH:74][cH:75]1)[c:76]2[C:77]([NH:78][CH3:79])=[O:80]>>[CH:1]1([c:4]2[cH:5][c:6]3[c:7]([C:46](=[O:47])[NH:48][CH3:49])[n:8](-[c:32]4[cH:33][cH:34][c:35]([NH:38][c:39]5[cH:40][cH:41][c:42]([F:45])[cH:43][cH:44]5)[cH:36][cH:37]4)[n:9][c:10]3[cH:11][c:12]2[N:13]([S:14](=[O:15])(=[O:16])[CH3:17])[CH2:18][CH2:19][CH2:20][NH2:21])[CH2:2][CH2:3]1Participants
3
Sources & evidence
- ORD record
- ord-e3389c15282a4ec0a48b762857e9be9b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…