Hydrochloric Acid → HCID 178504087, compound

HRID 680965Notes

Reaction equation

HRID 680965 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]2[c:15]2[c:20]1[CH2:19][NH:18][CH:17]([C:21](=[O:22])[OH:23])[CH2:16]2.[CH3:26][I:27].[CH3:32][S:33]([CH3:34])=[O:35].[ClH:28].[Na+:25].[OH-:24].[OH2:36].[S:29]=[C:30]=[S:31]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]2[c:15]2[c:20]1[CH2:19][N:18]([C:30](=[S:29])[S:31][CH3:26])[CH:17]([C:21](=[O:22])[OH:23])[CH2:16]2

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6328Methyl iodideHCID 6348Carbon DisulfideHCID 13562004HCID 13562004, compound

Product 1

HCID 178504087HCID 178504087, compound

Sources & evidence

ORD record
ord-29750a02043c43c9bcef7f1d46316dd9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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