Hydrochloric Acid → HCID 178465138, compound

HRID 106452Notes

Reaction equation

HRID 106452 reaction equation
[C:34]([CH3:35])([CH3:36])([CH3:37])[N:38]=[C:39]=[O:40].[CH2:48]([Cl:49])[Cl:50].[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[ClH:1].[N+:2](=[O:3])([O-:4])[c:5]1[cH:6][cH:7][c:8]([CH:11]([CH3:12])[NH:13][C:14]([CH:15]([CH2:16][S:17][CH2:18][CH:19]2[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]2)[NH:25][C:26](=[O:27])[CH:28]2[NH:29][CH2:30][S:31][CH2:32]2)=[O:33])[cH:9][cH:10]1>>[N+:2](=[O:3])([O-:4])[c:5]1[cH:6][cH:7][c:8]([CH:11]([CH3:12])[NH:13][C:14]([CH:15]([CH2:16][S:17][CH2:18][CH:19]2[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]2)[NH:25][C:26](=[O:27])[CH:28]2[N:29]([C:39]([NH:38][C:34]([CH3:35])([CH3:36])[CH3:37])=[O:40])[CH2:30][S:31][CH2:32]2)=[O:33])[cH:9][cH:10]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 62412tert-Butyl isocyanateHCID 17791989HCID 17791989, compound

Product 1

HCID 178465138HCID 178465138, compound

Sources & evidence

ORD record
ord-d7bb909e60944af9992ec407a4a4489e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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