Dichloromethane → 3-Cycloheptyl-2-(1-oxo-1,3-dihydro-isoindol-2-yl)-N-thiazol-2-yl-propionamide

HRID 1135351Notes

Reaction equation

HRID 1135351 reaction equation
[C:93]([O:94][CH2:95][CH3:96])(=[O:97])[CH3:98].[CH2:90]([Cl:91])[Cl:92].[CH3:84][CH2:85][O:86][C:87](=[O:88])[CH3:89].[CH:1]1([CH2:2][CH:3]([N:4]2[CH2:5][c:6]3[c:7]([cH:8][cH:9][cH:10][c:11]3[S:12]([CH3:13])(=[O:14])=[O:15])[C:16]2=[O:17])[C:18]([OH:19])=[O:20])[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]1.[CH:26]1([CH2:27][CH:28]([N:29]2[CH2:30][c:31]3[c:32]([c:33]([S:34]([CH3:35])(=[O:36])=[O:37])[cH:38][cH:39][cH:40]3)[C:41]2=[O:42])[C:43]([OH:44])=[O:45])[CH2:46][CH2:47][CH2:48][CH2:49][CH2:50]1.[CH:58]1([CH2:64][CH:65]([C:66](=[O:67])[NH:68][c:69]2[s:70][cH:71][cH:72][n:73]2)[N:74]2[C:75](=[O:83])[c:76]3[cH:77][cH:78][cH:79][cH:80][c:81]3[CH2:82]2)[CH2:59][CH2:60][CH2:61][CH2:62][CH2:63]1.[NH2:51][c:52]1[cH:53][cH:54][n:55][cH:56][n:57]1>>[CH2:1]1[CH:58]([CH2:64][CH:65]([C:66](=[O:67])[NH:68][c:69]2[s:70][cH:71][cH:72][n:73]2)[N:74]2[C:75](=[O:83])[c:76]3[cH:77][cH:78][cH:79][cH:80][c:81]3[CH2:82]2)[CH2:59][CH2:60][CH2:61][CH2:62][CH2:63]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 8857Ethyl Acetate2×HCID 689584-AminopyrimidineHCID 184022003-cyclohexyl-2-(3-oxo-1H-isoindol-2-yl)-N-(1,3-thiazol-2-yl)propanamideHCID 184022083-cyclohexyl-2-(4-methylsulfonyl-3-oxo-1H-isoindol-2-yl)propanoic acidHCID 184022193-cyclohexyl-2-(7-methylsulfonyl-3-oxo-1H-isoindol-2-yl)propanoic acid

Product 1

HCID 102713163-Cycloheptyl-2-(1-oxo-1,3-dihydro-isoindol-2-yl)-N-thiazol-2-yl-propionamide

Sources & evidence

ORD record
ord-fe1c2615f27342499076184d46e73a25
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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