Ammonium → HCID 68857527, compound

HRID 175983Notes

Reaction equation

HRID 175983 reaction equation
[CH3:51][C:52]#[N:53].[Cl:1][c:2]1[c:3](-[c:19]2[cH:20][c:21]3[c:22]([s:23]2)[cH:24][c:25]([S:28][Si:29]([CH:30]([CH3:31])[CH3:32])([CH:33]([CH3:34])[CH3:35])[CH:36]([CH3:37])[CH3:38])[cH:26][cH:27]3)[n:4][c:5]([NH:8][CH2:9][CH2:10][CH2:11][N:12]2[CH2:13][CH2:14][N:15]([CH3:18])[CH2:16][CH2:17]2)[n:6][cH:7]1.[K+:39].[NH4+:49].[O-:40][N+:41](=[O:42])[O-:43].[OH-:50].[OH2:54].[S:44](=[O:45])(=[O:46])([Cl:47])[Cl:48]>>[Cl:1][c:2]1[c:3](-[c:19]2[cH:20][c:21]3[c:22]([s:23]2)[cH:24][c:25]([S:44](=[O:45])(=[O:46])[NH2:49])[cH:26][cH:27]3)[n:4][c:5]([NH:8][CH2:9][CH2:10][CH2:11][N:12]2[CH2:13][CH2:14][N:15]([CH3:18])[CH2:16][CH2:17]2)[n:6][cH:7]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 813Potassium CationHCID 943NitrateHCID 961HydroxideHCID 962WaterHCID 6342AcetonitrileHCID 24648Sulfuryl chlorideHCID 68856205HCID 68856205, compound

Product 1

HCID 68857527HCID 68857527, compound

Sources & evidence

ORD record
ord-f589fddb233c41b1a74b46b00eefbcd1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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