Hydrochloric Acid → HCID 178466448, compound

HRID 124206

Reaction equation

[C:2]([CH3:3])([CH3:4])([CH3:5])[c:6]1[cH:7][c:8]([O:45][CH2:46][CH3:47])[c:9]([C:12]2=[N:16][C:15]([CH3:17])([c:18]3[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]3)[C:14]([CH3:25])([c:26]3[cH:27][cH:28][c:29]([Cl:32])[cH:30][cH:31]3)[N:13]2[C:33](=[O:34])[N:35]2[CH2:36][CH2:37][N:38]([CH2:41][C:42](=[O:43])[OH:44])[CH2:39][CH2:40]2)[cH:10][n:11]1.[ClH:1].[NH:48]1[CH2:49][CH2:50][NH:51][C:52](=[O:55])[CH2:53][CH2:54]1>>[C:2]([CH3:3])([CH3:4])([CH3:5])[c:6]1[cH:7][c:8]([O:45][CH2:46][CH3:47])[c:9]([C:12]2=[N:16][C:15]([CH3:17])([c:18]3[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]3)[C:14]([CH3:25])([c:26]3[cH:27][cH:28][c:29]([Cl:32])[cH:30][cH:31]3)[N:13]2[C:33](=[O:34])[N:35]2[CH2:36][CH2:37][N:38]([CH2:41][C:42](=[O:44])[N:48]3[CH2:49][CH2:50][NH:51][C:52](=[O:55])[CH2:53][CH2:54]3)[CH2:39][CH2:40]2)[cH:10][n:11]1

Participants

Reactant 3

HCID 313Hydrochloric Acid

HCID 27372641,4-Diazepan-5-one

HCID 178466472HCID 178466472, compound

Product 1

HCID 178466448HCID 178466448, compound

Sources & evidence

ORD record: ord-c2869a4fc8274960b2981d849775e55a
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Linked notes

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