Hydrochloric Acid → HCID 178465518, compound

HRID 2320806Notes

Reaction equation

HRID 2320806 reaction equation
[Br:28][CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[CH2:21]([N:22]([CH2:23][CH3:24])[CH2:25][CH3:26])[CH3:27].[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[ClH:36].[NH2:1][CH:2]([CH3:3])[C:4](=[O:5])[N:6]1[CH:7]([C:8](=[O:9])[N:10]2[CH:11]([C:12](=[O:13])[OH:14])[CH2:15][CH2:16][CH2:17]2)[CH2:18][CH2:19][CH2:20]1.[O:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[OH2:46].[OH2:53].[S:37]=[C:38]=[S:39]>>[NH:1]([CH:2]([CH3:3])[C:4](=[O:5])[N:6]1[CH:7]([C:8](=[O:9])[N:10]2[CH:11]([C:12](=[O:13])[OH:14])[CH2:15][CH2:16][CH2:17]2)[CH2:18][CH2:19][CH2:20]1)[C:38](=[S:37])[S:39][CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 962Water2×HCID 6348Carbon DisulfideHCID 7498Benzyl BromideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 312751,4-DioxaneHCID 90721Alanylprolylproline

Product 1

HCID 178465518HCID 178465518, compound

Sources & evidence

ORD record
ord-18608fa0d4f245a4b1849ee4e88b5424
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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