Hydrochloric Acid → HCID 59426223, compound

HRID 2154115Notes

Reaction equation

HRID 2154115 reaction equation
[CH2:46]([C:47]([CH3:48])=[O:49])[CH3:50].[Cl:37][CH2:38][CH2:39][N:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[ClH:36].[I-:35].[K+:28].[K+:29].[Na+:34].[O-:30][C:31]([O-:32])=[O:33].[O:1]=[S:2]1(=[O:27])[N:3]([c:7]2[cH:8][cH:9][c:10](-[c:13]3[n:14]([CH2:25][CH3:26])[c:15]4[cH:16][c:17]([OH:24])[cH:18][cH:19][c:20]4[c:21]3[C:22]#[N:23])[cH:11][cH:12]2)[CH2:4][CH2:5][CH2:6]1.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH2:51]>>[O:1]=[S:2]1(=[O:27])[N:3]([c:7]2[cH:8][cH:9][c:10](-[c:13]3[n:14]([CH2:25][CH3:26])[c:15]4[cH:16][c:17]([O:24][CH2:38][CH2:39][N:40]5[CH2:41][CH2:42][O:43][CH2:44][CH2:45]5)[cH:18][cH:19][c:20]4[c:21]3[C:22]#[N:23])[cH:11][cH:12]2)[CH2:4][CH2:5][CH2:6]1

Participants

11

Reactant 10

HCID 313Hydrochloric AcidHCID 813Potassium Cation2×HCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 6569Methyl Ethyl KetoneHCID 19660Carbonate IonHCID 30165Iodide IonHCID 767274-(2-Chloroethyl)morpholineHCID 59425169HCID 59425169, compound

Product 1

HCID 59426223HCID 59426223, compound

Sources & evidence

ORD record
ord-bf78b784f1b24740bad4d45ff0533852
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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