Dimethyl Sulfoxide → HCID 18791391, compound

HRID 1122408Notes

Reaction equation

HRID 1122408 reaction equation
[C:11]([CH3:12])([CH3:13])([CH3:14])[O:15][C:16](=[O:17])[NH:18][CH2:19][CH2:20][CH2:21][O:22][c:23]1[c:24]([C:25](=[O:26])[NH:27][c:28]2[c:29]([O:53][CH3:54])[cH:30][c:31]([C:32](=[O:33])[N:34]([c:35]3[c:36]([O:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][OH:49])[cH:37][c:38]([CH3:41])[cH:39][cH:40]3)[CH3:50])[cH:51][cH:52]2)[cH:55][cH:56][cH:57][cH:58]1.[CH3:59][CH2:60][N:61]([CH2:62][CH3:63])[CH2:64][CH3:65].[CH3:7][S:8](=[O:9])[CH3:10].[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[Cl:66][CH2:67][Cl:68].[OH2:69]>>[C:11]([CH3:12])([CH3:13])([CH3:14])[O:15][C:16](=[O:17])[NH:18][CH2:19][CH2:20][CH2:21][O:22][c:23]1[c:24]([C:25](=[O:26])[NH:27][c:28]2[c:29]([O:53][CH3:54])[cH:30][c:31]([C:32](=[O:33])[N:34]([c:35]3[c:36]([O:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH:48]=[O:49])[cH:37][c:38]([CH3:41])[cH:39][cH:40]3)[CH3:50])[cH:51][cH:52]2)[cH:55][cH:56][cH:57][cH:58]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 6344DichloromethaneHCID 8471TriethylamineHCID 65578Oxalyl chlorideHCID 18791397HCID 18791397, compound

Product 1

HCID 18791391HCID 18791391, compound

Sources & evidence

ORD record
ord-6bc892e3745040fdb30f2f6531a7ea68
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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