Ammonium → HCID 68417685, compound

HRID 1569782Notes

Reaction equation

HRID 1569782 reaction equation
[C:39]([CH3:40])([CH3:41])([CH3:42])[O:43][C:44](=[O:45])[CH2:46][NH:47][CH2:48][CH2:49][CH2:50][C:51]([OH:52])=[O:53].[CH2:74]([N:75]=[C:76]=[N:77][CH2:78][CH2:79][CH2:80][N:81]([CH3:82])[CH3:83])[CH3:84].[CH3:1][O:2][C:3]([c:4]1[c:5]([O:29][CH3:30])[cH:6][c:7]([CH3:28])[c:8](-[c:10]2[n:11][c:12]([NH2:27])[n:13][c:14]([S:16][CH2:17][CH2:18][NH:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[cH:15]2)[cH:9]1)=[O:31].[CH:64]([N:65]([CH:66]([CH3:67])[CH3:68])[CH2:69][CH3:70])([CH3:71])[CH3:72].[Cl-:85].[Cl:87][CH2:88][Cl:89].[ClH:73].[NH4+:86].[OH:32][C:33]([C:34]([F:35])([F:36])[F:37])=[O:38].[OH:54][n:55]1[c:56]2[cH:57][cH:58][cH:59][cH:60][c:61]2[n:62][n:63]1>>[CH3:1][O:2][C:3]([c:4]1[c:5]([O:29][CH3:30])[cH:6][c:7]([CH3:28])[c:8](-[c:10]2[n:11][c:12]([NH2:27])[n:13][c:14]([S:16][CH2:17][CH2:18][NH:19][C:20](=[O:21])[CH2:50][CH2:49][CH2:48][NH:47][CH2:46][C:44]([O:43][C:39]([CH3:40])([CH3:41])[CH3:42])=[O:45])[cH:15]2)[cH:9]1)=[O:31]

Participants

11

Reactant 10

HCID 223AmmoniumHCID 312ChlorideHCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 216437024-[(2-tert-Butoxy-2-oxoethyl)amino]butanoic acidHCID 592246725-[2-Amino-6-(2-tert-butoxycarbonylaminoethylsulfanyl)pyrimidin-4-yl]-2-methoxy-4-methylbenzoic acid methyl ester

Product 1

HCID 68417685HCID 68417685, compound

Sources & evidence

ORD record
ord-0e2b9548c1df47edbc10d48a0a97201a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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