Chloride → HCID 18613202, compound

HRID 170912Notes

Reaction equation

HRID 170912 reaction equation
[CH2:37]([CH3:38])[NH:39][CH2:40][CH3:41].[Cl-:36].[Cl:1][c:2]1[c:3]([N:27]([CH2:28][CH2:29][CH3:30])[CH3:31])[cH:4][c:5]2[c:6]([cH:26]1)[NH:7][C:8](=[O:25])[CH2:9][C:10]([c:12]1[cH:13][c:14](-[n:18]3[n:19][n:20][cH:21][c:22]3[CH2:23][OH:24])[cH:15][cH:16][cH:17]1)=[N:11]2.[Cl:42][CH2:43][Cl:44].[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[S:32]([Cl:33])([Cl:34])=[O:35]>>[Cl:1][c:2]1[c:3]([N:27]([CH2:28][CH2:29][CH3:30])[CH3:31])[cH:4][c:5]2[c:6]([cH:26]1)[NH:7][C:8](=[O:25])[CH2:9][C:10]([c:12]1[cH:13][c:14](-[n:18]3[n:19][n:20][cH:21][c:22]3[CH2:23][N:39]([CH2:37][CH3:38])[CH2:40][CH3:41])[cH:15][cH:16][cH:17]1)=[N:11]2

Participants

7

Reactant 6

HCID 312ChlorideHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8021DiethylamineHCID 24386Thionyl ChlorideHCID 18613113HCID 18613113, compound

Product 1

HCID 18613202HCID 18613202, compound

Sources & evidence

ORD record
ord-e58b8cbfa32249f2a52d53ca9f41f5d9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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