Hydrochloric Acid → HCID 12947041, compound

HRID 682715Notes

Reaction equation

HRID 682715 reaction equation
[CH3:23][OH:24].[Cl:1][c:2]1[c:3]([C:8]2=[N:9][CH2:10][C:11](=[S:20])[NH:12][c:13]3[c:14]2[cH:15][c:16]([Cl:19])[cH:17][cH:18]3)[cH:4][cH:5][cH:6][cH:7]1.[Cl:26][CH2:27][CH2:28][N:29]1[CH2:30][CH2:31][CH2:32][CH2:33]1.[ClH:25].[Na+:22].[OH-:21].[OH2:34]>>[Cl:1][c:2]1[c:3]([C:8]2=[N:9][CH2:10][C:11]([S:20][CH2:27][CH2:28][N:29]3[CH2:30][CH2:31][CH2:32][CH2:33]3)=[N:12][c:13]3[c:14]2[cH:15][c:16]([Cl:19])[cH:17][cH:18]3)[cH:4][cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 816691-(2-Chloroethyl)pyrrolidineHCID 8267037-chloro 5-(2-chlorophenyl)-1,3-dihydro-2H-(1,4)-benzodiazepine-2-thione

Product 1

HCID 12947041HCID 12947041, compound

Sources & evidence

ORD record
ord-b102c0f28b134af596b0f4e80b6f338c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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