Dimethylformamide → tert-butyl N-[3-[4-(9H-fluoren-9-ylmethoxycarbonylamino)phenyl]-1-[2-[5-(4-fluorobenzoyl)-3-pyridinyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]carbamate

HRID 1553568Notes

Reaction equation

HRID 1553568 reaction equation
[C:21]([CH3:22])([CH3:23])([CH3:24])[O:25][C:26](=[O:27])[NH:28][CH:29]([C:30](=[O:31])[OH:32])[CH2:33][c:34]1[cH:35][cH:36][c:37]([NH:40][C:41](=[O:42])[O:43][CH2:44][CH:45]2[c:46]3[cH:47][cH:48][cH:49][cH:50][c:51]3-[c:52]3[cH:53][cH:54][cH:55][cH:56][c:57]32)[cH:38][cH:39]1.[CH2:58]([N:59]([CH:60]([CH3:61])[CH3:62])[CH:63]([CH3:64])[CH3:65])[CH3:66].[CH3:82][CH2:83][O:84][C:85](=[O:86])[CH3:87].[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[c:10]2[cH:11][n:12][cH:13][c:14]([CH:16]3[NH:17][CH2:18][CH2:19][CH2:20]3)[cH:15]2)[cH:6][cH:7]1.[O:77]=[CH:78][N:79]([CH3:80])[CH3:81].[n:67]1([OH:68])[c:69]2[cH:70][cH:71][cH:72][cH:73][c:74]2[n:75][n:76]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[c:10]2[cH:11][n:12][cH:13][c:14]([CH:16]3[N:17]([C:30]([CH:29]([NH:28][C:26]([O:25][C:21]([CH3:22])([CH3:23])[CH3:24])=[O:27])[CH2:33][c:34]4[cH:35][cH:36][c:37]([NH:40][C:41](=[O:42])[O:43][CH2:44][CH:45]5[c:46]6[cH:47][cH:48][cH:49][cH:50][c:51]6-[c:52]6[cH:53][cH:54][cH:55][cH:56][c:57]65)[cH:38][cH:39]4)=[O:31])[CH2:18][CH2:19][CH2:20]3)[cH:15]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 4712502Boc-DL-Phe(4-NHFmoc)-OHHCID 57517429(4-Fluorophenyl)-(5-pyrrolidin-2-yl-3-pyridinyl)methanone

Product 1

HCID 67341787tert-butyl N-[3-[4-(9H-fluoren-9-ylmethoxycarbonylamino)phenyl]-1-[2-[5-(4-fluorobenzoyl)-3-pyridinyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]carbamate

Sources & evidence

ORD record
ord-f2a9464bbe0f4c309ad8f3a1f6415b37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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