Ammonium → HCID 45278975, compound

HRID 663791Notes

Reaction equation

HRID 663791 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([O:31][CH3:32])[cH:33][cH:34][c:35]1[CH2:36][NH:6][CH:7]1[CH2:8][CH2:9][CH:10]([NH:13][S:14](=[O:15])(=[O:16])[c:17]2[cH:18][cH:19][c:20](-[c:23]3[c:24]([F:30])[cH:25][c:26]([F:29])[cH:27][cH:28]3)[cH:21][cH:22]2)[CH2:11][CH2:12]1.[CH3:43][C:44]#[N:45].[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[NH4+:38].[O-:39][N+:40](=[O:41])[O-:42].[OH2:37]>>[NH2:6][CH:7]1[CH2:8][CH2:9][CH:10]([NH:13][S:14](=[O:15])(=[O:16])[c:17]2[cH:18][cH:19][c:20](-[c:23]3[c:24]([F:30])[cH:25][c:26]([F:29])[cH:27][cH:28]3)[cH:21][cH:22]2)[CH2:11][CH2:12]1

Participants

7

Reactant 6

HCID 223AmmoniumHCID 943NitrateHCID 962WaterHCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 67314026HCID 67314026, compound

Product 1

HCID 45278975HCID 45278975, compound

Sources & evidence

ORD record
ord-cdb4082ec969435fbe6d0d4b11e25f84
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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