1,2-Dichloroethane → HCID 178473372, compound

HRID 1205277Notes

Reaction equation

HRID 1205277 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12]([CH:13]([CH2:14][CH2:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[NH:23][C:24](=[O:25])[c:26]2[n:27][n:28](-[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[c:29]([O:31][CH2:32][C:33](=[O:34])[OH:35])[cH:30]2)=[O:42])[CH2:10][CH2:11]1.[CH2:62]([c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1)[O:69][C:70](=[O:71])[C:72]1([NH2:76])[CH2:73][CH2:74][CH2:75]1.[CH2:88]([Cl:89])[CH2:90][Cl:91].[CH3:82][CH2:83][O:84][C:85](=[O:86])[CH3:87].[CH:53]([N:54]([CH2:55][CH3:56])[CH:57]([CH3:58])[CH3:59])([CH3:60])[CH3:61].[O:77]=[CH:78][N:79]([CH3:80])[CH3:81].[OH:43][n:44]1[c:45]2[c:46]([cH:47][cH:48][cH:49][cH:50]2)[n:51][n:52]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12]([CH:13]([CH2:14][CH2:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[NH:23][C:24](=[O:25])[c:26]2[n:27][n:28](-[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[c:29]([O:31][CH2:32][C:33](=[O:34])[NH:76][C:72]3([C:70]([O:69][CH2:62][c:63]4[cH:64][cH:65][cH:66][cH:67][cH:68]4)=[O:71])[CH2:73][CH2:74][CH2:75]3)[cH:30]2)=[O:42])[CH2:10][CH2:11]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 22120948Benzyl 1-aminocyclobutane-1-carboxylateHCID 668560712-[3-[[1-(4-Ethoxycarbonylpiperazin-1-yl)-5-[(2-methylpropan-2-yl)oxy]-1,5-dioxopentan-2-yl]carbamoyl]-1-phenylpyrazol-5-yl]oxyacetic acid

Product 1

HCID 178473372HCID 178473372, compound

Sources & evidence

ORD record
ord-ed219eb450344c9dbe47849de7012f93
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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