Hydrochloric Acid → HCID 178454929, compound

HRID 2319684Notes

Reaction equation

HRID 2319684 reaction equation
[C:28]([CH3:29])([CH3:30])([CH3:31])[O:32][C:33](=[O:34])[NH:35][CH:36]([C:37](=[O:38])[OH:39])[C:40]([CH3:41])([CH3:42])[CH3:43].[CH:68]([N:69]([CH2:70][CH3:71])[CH:72]([CH3:73])[CH3:74])([CH3:75])[CH3:76].[Cl:77][CH2:78][Cl:79].[ClH:27].[P-:44]([F:45])([F:46])([F:47])([F:48])([F:49])[F:50].[c:1]1(-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:2][cH:3][c:4]([C:7]2([S:16][CH2:17][CH2:18][CH2:19][CH3:20])[CH2:8][CH:9]([C:12](=[O:13])[O:14][CH3:15])[NH:10][CH2:11]2)[cH:5][cH:6]1.[n:51]1([O:52][C:53]([N:54]([CH3:55])[CH3:56])=[N+:57]([CH3:58])[CH3:59])[c:60]2[n:61][cH:62][cH:63][cH:64][c:65]2[n:66][n:67]1>>[c:1]1(-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:2][cH:3][c:4]([C:7]2([S:16][CH2:17][CH2:18][CH2:19][CH3:20])[CH2:8][CH:9]([C:12](=[O:13])[O:14][CH3:15])[N:10]([C:37]([CH:36]([NH:35][C:33]([O:32][C:28]([CH3:29])([CH3:30])[CH3:31])=[O:34])[C:40]([CH3:41])([CH3:42])[CH3:43])=[O:38])[CH2:11]2)[cH:5][cH:6]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 50468592-{[(Tert-butoxy)carbonyl]amino}-3,3-dimethylbutanoic acidHCID 67030398Methyl 4-butylsulfanyl-4-(4-phenylphenyl)pyrrolidine-2-carboxylate

Product 1

HCID 178454929HCID 178454929, compound

Sources & evidence

ORD record
ord-be8e8101844d4d91bb3f2f91c194b68d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…