Hydrochloric Acid → HCID 67178072, compound

HRID 1118817Notes

Reaction equation

HRID 1118817 reaction equation
[CH2:2]([CH3:3])[NH:4][C:5](=[O:6])[NH:7][c:8]1[cH:9][cH:10][c:11](-[c:14]2[n:15][c:16]([N:24]3[CH:25]([CH3:30])[CH2:26][O:27][CH2:28][CH2:29]3)[c:17]3[c:18]([n:19]2)[CH2:20][CH2:21][NH:22][CH2:23]3)[cH:12][cH:13]1.[CH3:31][N:32]([CH3:33])[CH:34]=[O:35].[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[CH:45]1([S:48](=[O:49])(=[O:50])[Cl:51])[CH2:46][CH2:47]1.[ClH:1]>>[CH2:2]([CH3:3])[NH:4][C:5](=[O:6])[NH:7][c:8]1[cH:9][cH:10][c:11](-[c:14]2[n:15][c:16]([N:24]3[CH:25]([CH3:30])[CH2:26][O:27][CH2:28][CH2:29]3)[c:17]3[c:18]([n:19]2)[CH2:20][CH2:21][N:22]([S:48]([CH:45]2[CH2:46][CH2:47]2)(=[O:49])=[O:50])[CH2:23]3)[cH:12][cH:13]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 81531DiisopropylethylamineHCID 2760919Cyclopropanesulfonyl chlorideHCID 666884051-Ethyl-3-[4-[4-(3-methylmorpholin-4-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl]phenyl]urea

Product 1

HCID 67178072HCID 67178072, compound

Sources & evidence

ORD record
ord-ebe028247abf4de9851f64a07cdce39e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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