Water → HCID 136054869, compound

HRID 187166Notes

Reaction equation

HRID 187166 reaction equation
[C:22](=[O:23])=[N:24][S:25]([Cl:26])(=[O:27])=[O:28].[NH2:1][c:2]1[n:3][n:4][c:5](-[c:7]2[cH:8][c:9]([C:18]([CH3:19])([CH3:20])[CH3:21])[c:10]([OH:17])[c:11]([C:13]([CH3:14])([CH3:15])[CH3:16])[cH:12]2)[s:6]1.[OH2:29]>>[NH:1]([c:2]1[n:3][n:4][c:5](-[c:7]2[cH:8][c:9]([C:18]([CH3:19])([CH3:20])[CH3:21])[c:10]([OH:17])[c:11]([C:13]([CH3:14])([CH3:15])[CH3:16])[cH:12]2)[s:6]1)[C:22](=[O:23])[NH2:24]

Participants

4

Reactant 3

HCID 962WaterHCID 70918Chlorosulfonyl isocyanateHCID 135518175HCID 135518175, compound

Product 1

HCID 136054869HCID 136054869, compound

Sources & evidence

ORD record
ord-44f94c3d808c40a3b4ef1ded7b7e1d2a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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