Hydrochloric Acid → tert-butyl N-[1-[[1-(methanesulfonamido)-3-phenylpropan-2-yl]-methylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-N-methylcarbamate

HRID 677779Notes

Reaction equation

HRID 677779 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([CH3:9])[CH:10]([C:11](=[O:12])[OH:13])[CH2:14][c:15]1[cH:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]2[cH:23][cH:24]1.[CH2:63]([N:64]([CH:65]([CH3:66])[CH3:67])[CH:68]([CH3:69])[CH3:70])[CH3:71].[CH3:36][N:37]([CH3:38])[CH2:39][CH2:40][CH2:41][N:42]=[C:43]=[N:44][CH2:45][CH3:46].[CH3:47][NH:48][CH:49]([CH2:50][NH:51][S:52](=[O:53])(=[O:54])[CH3:55])[CH2:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[CH3:72][N:73]([CH3:74])[CH:75]=[O:76].[CH3:80][CH2:81][O:82][C:83](=[O:84])[CH3:85].[Cl:77][CH2:78][Cl:79].[ClH:35].[OH:25][c:26]1[c:27]2[n:28][n:29][nH:30][c:31]2[n:32][cH:33][cH:34]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([CH3:9])[CH:10]([C:11](=[O:12])[N:48]([CH3:47])[CH:49]([CH2:50][NH:51][S:52](=[O:53])(=[O:54])[CH3:55])[CH2:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1)[CH2:14][c:15]1[cH:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]2[cH:23][cH:24]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 81531DiisopropylethylamineHCID 223269722-[Methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-naphthalen-2-ylpropanoic acidHCID 22327003N-[2-(methylamino)-3-phenylpropyl]methanesulfonamideHCID 1785164692,3-dihydrotriazolo[4,5-b]pyridin-7-one

Product 1

HCID 20827582tert-butyl N-[1-[[1-(methanesulfonamido)-3-phenylpropan-2-yl]-methylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-N-methylcarbamate

Sources & evidence

ORD record
ord-0a328b0568f449c7a814ef75b8116574
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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