Hydrochloric Acid → Hydrochloric Acid

HRID 122547

Reaction equation

HRID 122547 reaction equation
[CH3:26][CH2:27][OH:28].[CH3:41][S:42]([CH3:43])=[O:44].[Cl:30][c:31]1[cH:32][cH:33][n:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]12.[ClH:1].[ClH:2].[NH2:3][c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[NH:10][c:11]2[cH:12][c:13]([C:17]([CH3:18])=[N:19][N:20]=[C:21]([NH2:22])[NH2:23])[cH:14][cH:15][cH:16]2)[cH:24][cH:25]1.[OH2:29]>>[ClH:1].[ClH:30].[NH:3]([c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[NH:10][c:11]2[cH:12][c:13]([C:17]([CH3:18])=[N:19][N:20]=[C:21]([NH2:22])[NH2:23])[cH:14][cH:15][cH:16]2)[cH:24][cH:25]1)[c:31]1[cH:32][cH:33][n:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]12

Participants

8

Reactant 6

HCID 313Hydrochloric Acid2×HCID 679Dimethyl SulfoxideHCID 702EthanolHCID 962WaterHCID 691404-ChloroquinolineHCID 915910364-amino-N-[3-[N-(diaminomethylideneamino)-C-methylcarbonimidoyl]phenyl]benzamide

Product 2

HCID 313Hydrochloric Acid2×HCID 72290609HCID 72290609, compound

Sources & evidence

ORD record
ord-4c64d1aee5cf4124a200f9028473bd8f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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