Hydrochloric Acid → HCID 18753379, compound

HRID 1569472Notes

Reaction equation

HRID 1569472 reaction equation
[CH2:41]([Cl:42])[Cl:43].[CH3:18][O:19][c:20]1[c:21]([N:26]2[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]2)[cH:22][cH:23][cH:24][cH:25]1.[CH:32]([N:33]([CH:34]([CH3:35])[CH3:36])[CH2:37][CH3:38])([CH3:39])[CH3:40].[ClH:17].[c:1]1([C:7]2=[N:8][O:9][CH:10]([CH2:12][CH2:13][CH2:14][CH:15]=[O:16])[CH2:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]2=[N:8][O:9][CH:10]([CH2:12][CH2:13][CH2:14][CH2:15][CH:27]3[N:26]([c:21]4[c:20]([O:19][CH3:18])[cH:25][cH:24][cH:23][cH:22]4)[CH2:31][CH2:30][NH:29][CH2:28]3)[CH2:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 13461-(2-Methoxyphenyl)piperazineHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 187533924-(3-Phenyl-4,5-dihydroisoxazol-5-yl)butanal

Product 1

HCID 18753379HCID 18753379, compound

Sources & evidence

ORD record
ord-c4c777b0afb94c49b319ffa38524cd20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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