Chloride → HCID 18613222, compound

HRID 1136921Notes

Reaction equation

HRID 1136921 reaction equation
[CH2:41]1[CH2:42][CH2:43][NH:44][CH2:45]1.[Cl-:40].[Cl:46][CH2:47][Cl:48].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH:1][CH2:2][c:3]1[cH:4][n:5][n:6][n:7]1-[c:8]1[cH:9][c:10]([C:14]2=[N:15][c:16]3[c:17]([cH:22][c:23]([C:32]([F:33])([F:34])[F:35])[c:24]([N:26]([CH3:27])[CH2:28][CH:29]([CH3:30])[CH3:31])[cH:25]3)[NH:18][C:19](=[O:21])[CH2:20]2)[cH:11][cH:12][cH:13]1.[S:36]([Cl:37])([Cl:38])=[O:39]>>[CH2:2]([c:3]1[cH:4][n:5][n:6][n:7]1-[c:8]1[cH:9][c:10]([C:14]2=[N:15][c:16]3[c:17]([cH:22][c:23]([C:32]([F:33])([F:34])[F:35])[c:24]([N:26]([CH3:27])[CH2:28][CH:29]([CH3:30])[CH3:31])[cH:25]3)[NH:18][C:19](=[O:21])[CH2:20]2)[cH:11][cH:12][cH:13]1)[N:44]1[CH2:43][CH2:42][CH2:41][CH2:45]1

Participants

7

Reactant 6

HCID 312ChlorideHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 24386Thionyl ChlorideHCID 31268PyrrolidineHCID 18613095HCID 18613095, compound

Product 1

HCID 18613222HCID 18613222, compound

Sources & evidence

ORD record
ord-a00c3faecb4742179b4e9de3fbdce083
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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