Chloride → HCID 178489932, compound

HRID 2136691Notes

Reaction equation

HRID 2136691 reaction equation
[CH3:28][O:29][c:30]1[cH:31][c:32](-[c:36]2[nH:37][c:38]([NH2:41])[n:39][n:40]2)[cH:33][cH:34][cH:35]1.[CH:19]([N:20]([CH2:21][CH3:22])[CH:23]([CH3:24])[CH3:25])([CH3:26])[CH3:27].[CH:1]1([CH2:4][S:5](=[O:6])(=[O:7])[C:8]([C:9](=[O:10])[OH:11])([CH3:12])[CH3:13])[CH2:2][CH2:3]1.[Cl-:14].[S:15]([Cl:16])([Cl:17])=[O:18]>>[CH:1]1([CH2:4][S:5](=[O:6])(=[O:7])[C:8]([C:9](=[O:11])[NH:41][c:38]2[nH:37][c:36](-[c:32]3[cH:31][c:30]([O:29][CH3:28])[cH:35][cH:34][cH:33]3)[n:40][n:39]2)([CH3:12])[CH3:13])[CH2:2][CH2:3]1

Participants

6

Reactant 5

HCID 312ChlorideHCID 24386Thionyl ChlorideHCID 81531DiisopropylethylamineHCID 59253257HCID 59253257, compoundHCID 178489933HCID 178489933, compound

Product 1

HCID 178489932HCID 178489932, compound

Sources & evidence

ORD record
ord-88146be2ef4641d1b358bf54737a2a14
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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