Hydrochloric Acid → HCID 10477811, compound

HRID 1113540Notes

Reaction equation

HRID 1113540 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH:10]2[CH2:11][CH2:12][N:13]([S:16](=[O:17])(=[O:18])[C:19]3([C:25](=[O:26])[NH:27][O:28][CH:29]4[CH2:30][CH2:31][CH2:32][CH2:33][O:34]4)[CH2:20][CH2:21][O:22][CH2:23][CH2:24]3)[CH2:14][CH2:15]2)[s:9]1.[CH2:86]([Cl:87])[Cl:88].[CH3:43][N:44]([CH3:45])[CH2:46][CH2:47][CH2:48][N:49]=[C:50]=[N:51][CH2:52][CH3:53].[CH3:73][N:74]1[CH2:75][CH2:76][O:77][CH2:78][CH2:79]1.[CH3:80][CH2:81][O:82][C:83](=[O:84])[CH3:85].[ClH:42].[O:65]1[CH2:66][CH2:67][CH2:68][CH2:69][CH:70]1[O:71][NH2:72].[OH2:54].[OH:35][C:36]([C:37]([F:38])([F:39])[F:40])=[O:41].[OH:55][n:56]1[c:57]2[cH:58][cH:59][cH:60][cH:61][c:62]2[n:63][n:64]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH:10]2[CH2:11][CH2:12][N:13]([S:16](=[O:17])(=[O:18])[C:19]3([C:25](=[O:26])[NH:27][OH:28])[CH2:20][CH2:21][O:22][CH2:23][CH2:24]3)[CH2:14][CH2:15]2)[s:9]1

Participants

11

Reactant 10

HCID 313Hydrochloric AcidHCID 962WaterHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 79724-MethylmorpholineHCID 8857Ethyl AcetateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 5142091O-(Tetrahydropyran-2-yl)hydroxylamineHCID 21931246HCID 21931246, compound

Product 1

HCID 10477811HCID 10477811, compound

Sources & evidence

ORD record
ord-d7b1f720cd984bb2862a155fe8a87682
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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