Hydrochloric Acid → 1-(2-chlorophenyl)-5-(9(4-chlorophenyl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-2-yl)-1H-1,2,4-triazol-3-amine

HRID 296954Notes

Reaction equation

HRID 296954 reaction equation
[CH3:1][CH2:2][O:3][C:4]([CH3:5])=[O:6].[CH3:45][CH2:46][O:47][C:48]([CH3:49])=[O:50].[Cl:8][c:9]1[c:10](-[n:15]2[n:16][c:17]([NH:41][C:42](=[O:43])[OH:44])[n:18][c:19]2-[c:20]2[n:21][c:22]3[n:23]([cH:40]2)[CH2:24][CH2:25][O:26][c:27]2[c:28]-3[cH:29][cH:30][c:31](-[c:33]3[cH:34][cH:35][c:36]([Cl:39])[cH:37][cH:38]3)[cH:32]2)[cH:11][cH:12][cH:13][cH:14]1.[ClH:7]>>[Cl:8][c:9]1[c:10](-[n:15]2[n:16][c:17]([NH2:41])[n:18][c:19]2-[c:20]2[n:21][c:22]3[n:23]([cH:40]2)[CH2:24][CH2:25][O:26][c:27]2[c:28]-3[cH:29][cH:30][c:31](-[c:33]3[cH:34][cH:35][c:36]([Cl:39])[cH:37][cH:38]3)[cH:32]2)[cH:11][cH:12][cH:13][cH:14]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 8857Ethyl Acetate2×HCID 582050341-(2-chlorophenyl)-5-(9-(4-chlorophenyl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-2-yl)-1H-1,2,4-triazol-3-ylcarbamic acid

Product 1

HCID 582049001-(2-chlorophenyl)-5-(9(4-chlorophenyl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-2-yl)-1H-1,2,4-triazol-3-amine

Sources & evidence

ORD record
ord-cc471eb55fb54699bb747dc0528c3d76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…