1,2-Dichloroethane → HCID 178518563, compound

HRID 667676Notes

Reaction equation

HRID 667676 reaction equation
[C:34]([O:35][BH-:36]([O:37][C:38](=[O:39])[CH3:40])[O:41][C:42](=[O:43])[CH3:44])(=[O:45])[CH3:46].[CH3:48][C:49](=[O:50])[OH:51].[Cl:52][CH2:53][CH2:54][Cl:55].[NH2:22][CH2:23][CH:24]([CH2:25][O:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[OH:33].[Na+:47].[O:1]=[C:2]1[NH:3][C:4](=[S:21])[S:5][C:6]1=[CH:7][c:8]1[cH:9][cH:10][c:11]([N:14]2[CH2:15][CH2:16][C:17](=[O:20])[CH2:18][CH2:19]2)[cH:12][cH:13]1>>[O:1]=[C:2]1[NH:3][C:4](=[S:21])[S:5][C:6]1=[CH:7][c:8]1[cH:9][cH:10][c:11]([N:14]2[CH2:15][CH2:16][CH:17]([NH:22][CH2:23][CH:24]([CH2:25][O:26][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[OH:33])[CH2:18][CH2:19]2)[cH:12][cH:13]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 923Sodium ionHCID 2724942TriacetoxyborohydrideHCID 27250731-Amino-3-phenoxypropan-2-olHCID 731782011-[4-(4-Oxo-2-thioxo-thiazolidin-5-ylidenemethyl)-phenyl]-piperidin-4-one

Product 1

HCID 178518563HCID 178518563, compound

Sources & evidence

ORD record
ord-46fd6924238b4bd08a878da688d75e42
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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