Methanesulfonic Acid → HCID 21980755, compound

HRID 150675Notes

Reaction equation

HRID 150675 reaction equation
[CH2:47]1[CH2:48][O:49][CH2:50][CH2:51][NH:52]1.[CH3:37][S:38]([OH:39])(=[O:40])=[O:41].[CH3:42][S:43](=[O:44])(=[O:45])[Cl:46].[Cl:1][c:2]1[c:3](-[c:8]2[cH:9][c:10]3[n:11]([CH2:33][CH2:34][O:35][CH3:36])[c:12]4[cH:13][c:14]([O:28][CH2:29][CH2:30][CH2:31][OH:32])[c:15]([O:26][CH3:27])[cH:16][c:17]4[c:18]3[c:19]3[c:20]2[C:21](=[O:25])[NH:22][C:23]3=[O:24])[cH:4][cH:5][cH:6][cH:7]1>>[Cl:1][c:2]1[c:3](-[c:8]2[cH:9][c:10]3[n:11]([CH2:33][CH2:34][O:35][CH3:36])[c:12]4[cH:13][c:14]([O:28][CH2:29][CH2:30][CH2:31][N:52]5[CH2:47][CH2:48][O:49][CH2:50][CH2:51]5)[c:15]([O:26][CH3:27])[cH:16][c:17]4[c:18]3[c:19]3[c:20]2[C:21](=[O:25])[NH:22][C:23]3=[O:24])[cH:4][cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 6395Methanesulfonic AcidHCID 8083MorpholineHCID 31297Methanesulfonyl chlorideHCID 21980697HCID 21980697, compound

Product 1

HCID 21980755HCID 21980755, compound

Sources & evidence

ORD record
ord-94568c984df0470a92e431a36783b318
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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