Acetate → HCID 18454316, compound

HRID 201906Notes

Reaction equation

HRID 201906 reaction equation
[CH2:30]1[O:31][CH2:32][CH2:33][CH2:34]1.[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([NH2:9])[cH:10][cH:11]1.[CH3:26][C:27](=[O:28])[O-:29].[ClH:12].[N:13]([O-:14])=[O:15].[NH2:17][c:18]1[cH:19][c:20]([CH3:24])[cH:21][cH:22][cH:23]1.[Na+:16].[Na+:25].[OH2:35]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([N:9]=[N:13][c:21]2[c:20]([CH3:24])[cH:19][c:18]([NH2:17])[cH:23][cH:22]2)[cH:10][cH:11]1

Participants

9

Reactant 8

HCID 175AcetateHCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 946NitriteHCID 962WaterHCID 7934m-ToluidineHCID 8028TetrahydrofuranHCID 796174-(Methylsulfonyl)aniline

Product 1

HCID 18454316HCID 18454316, compound

Sources & evidence

ORD record
ord-23c95dd808464ad290782991c7a71e57
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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