Water → HCID 178520830, compound

HRID 146848Notes

Reaction equation

HRID 146848 reaction equation
[Cl:1][c:2]1[cH:3][c:4]([C:8]2([OH:18])[C:9](=[O:17])[NH:10][c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]32)[cH:5][cH:6][cH:7]1.[NH2:27][CH2:28][CH2:29][CH2:30][OH:31].[OH2:43].[c:19]1([CH3:20])[c:21]([CH3:22])[cH:23][cH:24][cH:25][cH:26]1.[c:32]1([CH3:33])[cH:34][cH:35][c:36]([S:37]([OH:38])(=[O:39])=[O:40])[cH:41][cH:42]1>>[Cl:1][c:2]1[cH:3][c:4]([C:8]2([OH:18])[C:9]([NH:27][CH2:28][CH2:29][CH2:30][OH:31])=[N:10][c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]32)[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 7237O-XyleneHCID 90863-Amino-1-propanolHCID 21490326HCID 21490326, compound

Product 1

HCID 178520830HCID 178520830, compound

Sources & evidence

ORD record
ord-9a882cbcdaaf448f9fed9dadd90fa893
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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