1,2-Dichloroethane → HCID 54695946, compound

HRID 174771Notes

Reaction equation

HRID 174771 reaction equation
[CH2:31]([Cl:32])[CH2:33][Cl:34].[CH3:1][O:2][C:3](=[O:4])[C:5]1=[C:10]([OH:11])[c:9]2[c:8]([c:19]3[c:14]([cH:13][cH:12]2)[cH:15][cH:16][cH:17][cH:18]3)[S:7](=[O:20])(=[O:21])[N:6]1[CH3:22].[NH2:23][c:24]1[s:25][c:26]([CH3:30])[c:27]([CH3:29])[n:28]1>>[C:3](=[O:4])([C:5]1=[C:10]([OH:11])[c:9]2[c:8]([c:19]3[c:14]([cH:13][cH:12]2)[cH:15][cH:16][cH:17][cH:18]3)[S:7](=[O:20])(=[O:21])[N:6]1[CH3:22])[NH:23][c:24]1[s:25][c:26]([CH3:30])[c:27]([CH3:29])[n:28]1

Participants

4

Sources & evidence

ORD record
ord-d1b7badfc6bf4ba7bfb2e811d711bcf3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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