Hydrochloric Acid → HCID 20324097, compound

HRID 313875Notes

Reaction equation

HRID 313875 reaction equation
[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[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:24][CH2:25][CH2:26][CH2:27][N:28]1[CH2:29][CH2:30][N:31]([c:34]2[c:35]([O:40][CH3:41])[cH:36][cH:37][cH:38][cH:39]2)[CH2:32][CH2:33]1.[ClH:23].[H-:21].[Na+:22].[OH2:42]>>[Cl:1][c:2]1[c:3]([C:8]2=[N:9][CH2:10][C:11]([S:20][CH2:25][CH2:26][CH2:27][N:28]3[CH2:29][CH2:30][N:31]([c:34]4[c:35]([O:40][CH3:41])[cH:36][cH:37][cH:38][cH:39]4)[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 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 166653HydrideHCID 6226691-(3-Chloropropyl)-4-(2-methoxyphenyl)piperazineHCID 8267037-chloro 5-(2-chlorophenyl)-1,3-dihydro-2H-(1,4)-benzodiazepine-2-thione

Product 1

HCID 20324097HCID 20324097, compound

Sources & evidence

ORD record
ord-ca6bb486279c4ec2bebe13865c14fc49
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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