Water → HCID 66839436, compound

HRID 1206799Notes

Reaction equation

HRID 1206799 reaction equation
[CH2:49]([Cl:50])[Cl:51].[CH3:11][O:12][c:13]1[cH:14][c:15]([CH:25]=[CH:26][c:27]2[n:28][n:29]3[c:30]([n:41]2)[CH:31]([CH:35]2[CH2:36][CH2:37][NH:38][CH2:39][CH2:40]2)[CH2:32][CH2:33][CH2:34]3)[cH:16][cH:17][c:18]1-[n:19]1[cH:20][n:21][c:22]([CH3:24])[cH:23]1.[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[OH2:42].[c:1]1([S:7](=[O:8])(=[O:9])[Cl:10])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[N:38]2[CH2:37][CH2:36][CH:35]([CH:31]3[c:30]4[n:29]([n:28][c:27]([CH:26]=[CH:25][c:15]5[cH:14][c:13]([O:12][CH3:11])[c:18](-[n:19]6[cH:20][n:21][c:22]([CH3:24])[cH:23]6)[cH:17][cH:16]5)[n:41]4)[CH2:34][CH2:33][CH2:32]3)[CH2:40][CH2:39]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 962WaterHCID 6344DichloromethaneHCID 7369Benzenesulfonyl chlorideHCID 8857Ethyl AcetateHCID 66839485HCID 66839485, compound

Product 1

HCID 66839436HCID 66839436, compound

Sources & evidence

ORD record
ord-3ef642f9935845998210417e9def02f0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…