Dimethylformamide → Tert-butyl 2-[[4-[4-[(5,7-dichloro-4-methoxy-3-methyl-1-benzofuran-2-carbonyl)amino]phenyl]phenyl]sulfonylamino]-3-methylbutanoate

HRID 1150422Notes

Reaction equation

HRID 1150422 reaction equation
[C:18]([CH3:19])([CH3:20])([CH3:21])[O:22][C:23]([CH:24]([CH:25]([CH3:26])[CH3:27])[NH:28][S:29](=[O:30])(=[O:31])[c:32]1[cH:33][cH:34][c:35](-[c:38]2[cH:39][cH:40][c:41]([NH2:44])[cH:42][cH:43]2)[cH:36][cH:37]1)=[O:45].[CH:73]([N:74]([CH2:75][CH3:76])[CH:77]([CH3:78])[CH3:79])([CH3:80])[CH3:81].[Cl:1][c:2]1[cH:3][c:4]([Cl:17])[c:5]2[c:6]([c:7]([CH3:13])[c:8]([C:10](=[O:11])[OH:12])[o:9]2)[c:14]1[O:15][CH3:16].[O:82]=[CH:83][N:84]([CH3:85])[CH3:86].[P-:46]([F:47])([F:48])([F:49])([F:50])([F:51])[F:52].[n:53]1([O:54][P+:55]([N:56]([CH3:57])[CH3:58])([N:59]([CH3:60])[CH3:61])[N:62]([CH3:63])[CH3:64])[c:65]2[cH:66][cH:67][cH:68][cH:69][c:70]2[n:71][n:72]1>>[Cl:1][c:2]1[cH:3][c:4]([Cl:17])[c:5]2[c:6]([c:7]([CH3:13])[c:8]([C:10](=[O:12])[NH:44][c:41]3[cH:40][cH:39][c:38](-[c:35]4[cH:34][cH:33][c:32]([S:29]([NH:28][CH:24]([C:23]([O:22][C:18]([CH3:19])([CH3:20])[CH3:21])=[O:45])[CH:25]([CH3:26])[CH3:27])(=[O:30])=[O:31])[cH:37][cH:36]4)[cH:43][cH:42]3)[o:9]2)[c:14]1[O:15][CH3:16]

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 124335Benzotriazol-1-yloxy-tris(dimethylamino)phosphoniumHCID 68711776Tert-butyl 2-[[4-(4-aminophenyl)phenyl]sulfonylamino]-3-methylbutanoateHCID 687160205,7-Dichloro-4-methoxy-3-methyl-benzofuran-2-carboxylic acid

Product 1

HCID 68714774Tert-butyl 2-[[4-[4-[(5,7-dichloro-4-methoxy-3-methyl-1-benzofuran-2-carbonyl)amino]phenyl]phenyl]sulfonylamino]-3-methylbutanoate

Sources & evidence

ORD record
ord-56f25e16bc6c48fdbed3c4336e61c005
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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