p-Toluenesulfonic acid → HCID 68426121, compound

HRID 1216022Notes

Reaction equation

HRID 1216022 reaction equation
[CH3:38][N:39]1[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1.[Cl:45][S:46](=[O:47])(=[O:48])[CH2:49][C:50](=[O:51])[O:52][CH2:53][CH:54]1[c:55]2[cH:56][cH:57][cH:58][cH:59][c:60]2-[c:61]2[cH:62][cH:63][cH:64][cH:65][c:66]21.[Cl:67][CH2:68][Cl:69].[NH2:12][N:13]1[C:14](=[O:37])[N:15]([CH2:27][CH2:28][c:29]2[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]2)[CH:16]([c:18]2[cH:19][cH:20][c:21]([CH:24]3[CH2:25][CH2:26]3)[cH:22][cH:23]2)[CH2:17]1.[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1>>[NH:12]([N:13]1[C:14](=[O:37])[N:15]([CH2:27][CH2:28][c:29]2[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]2)[CH:16]([c:18]2[cH:19][cH:20][c:21]([CH:24]3[CH2:25][CH2:26]3)[cH:22][cH:23]2)[CH2:17]1)[S:46](=[O:47])(=[O:48])[CH2:49][C:50](=[O:51])[O:52][CH2:53][CH:54]1[c:55]2[cH:56][cH:57][cH:58][cH:59][c:60]2-[c:61]2[cH:62][cH:63][cH:64][cH:65][c:66]21

Participants

6

Reactant 5

HCID 6101p-Toluenesulfonic acidHCID 6344DichloromethaneHCID 79724-MethylmorpholineHCID 11142292HCID 11142292, compoundHCID 44541888HCID 44541888, compound

Product 1

HCID 68426121HCID 68426121, compound

Sources & evidence

ORD record
ord-a1c39537857f401aa213281e1e7dc91a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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