Dichloromethane → N-[6-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-2-[1-(4-methylphenyl)sulfonyl-3-oxopiperazin-2-yl]acetamide

HRID 120948Notes

Reaction equation

HRID 120948 reaction equation
[CH3:1][c:2]1[n:3][o:4][c:5](-[c:7]2[c:8](-[c:13]3[cH:14][c:15]4[c:20]([cH:21][cH:22]3)[CH:19]([NH2:23])[CH2:18][CH2:17][CH2:16]4)[cH:9][cH:10][cH:11][cH:12]2)[n:6]1.[CH3:69][CH2:70][N:71]=[C:72]=[N:73][CH2:74][CH2:75][CH2:76][N:77]([CH3:78])[CH3:79].[Cl:80][CH2:81][Cl:82].[O:24]=[C:25]1[CH:26]([CH2:41][C:42](=[O:43])[OH:44])[N:27]([S:31](=[O:32])(=[O:33])[c:34]2[cH:35][cH:36][c:37]([CH3:38])[cH:39][cH:40]2)[CH2:28][CH2:29][NH:30]1.[P-:45]([F:46])([F:47])([F:48])([F:49])([F:50])[F:51].[n:52]1([O:53][C:54]([N:55]([CH3:56])[CH3:57])=[N+:58]([CH3:59])[CH3:60])[c:61]2[n:62][cH:63][cH:64][cH:65][c:66]2[n:67][n:68]1>>[CH3:1][c:2]1[n:3][o:4][c:5](-[c:7]2[c:8](-[c:13]3[cH:14][c:15]4[c:20]([cH:21][cH:22]3)[CH:19]([NH:23][C:42]([CH2:41][CH:26]3[C:25](=[O:24])[NH:30][CH2:29][CH2:28][N:27]3[S:31](=[O:32])(=[O:33])[c:34]3[cH:35][cH:36][c:37]([CH3:38])[cH:39][cH:40]3)=[O:43])[CH2:18][CH2:17][CH2:16]4)[cH:9][cH:10][cH:11][cH:12]2)[n:6]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 620340531-[(4-methylphenyl)sulfonyl]-3-oxo-2-Piperazineacetic acidHCID 178434725HCID 178434725, compound

Product 1

HCID 59747954N-[6-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-2-[1-(4-methylphenyl)sulfonyl-3-oxopiperazin-2-yl]acetamide

Sources & evidence

ORD record
ord-2fda9f8becc24cedb0b5e09b9c7dc488
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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