Potassium Cation → methyl N-[2-[2-[5-[4-[6-[2-[1-[2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]naphthalen-2-yl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamate

HRID 2321344Notes

Reaction equation

HRID 2321344 reaction equation
[CH3:1][O:2][C:3]([NH:4][CH:5]([CH:6]([CH3:7])[CH3:8])[C:9](=[O:10])[N:11]1[CH:12]([c:16]2[nH:17][c:18](-[c:21]3[cH:22][c:23]4[cH:24][cH:25][c:26](-[c:31]5[cH:32][cH:33][c:34](-[c:37]6[nH:38][c:39]([CH:42]7[NH:43][CH2:44][CH2:45][CH2:46]7)[n:40][cH:41]6)[cH:35][cH:36]5)[cH:27][c:28]4[cH:29][cH:30]3)[cH:19][n:20]2)[CH2:13][CH2:14][CH2:15]1)=[O:47].[CH3:48][O:49][C:50](=[O:51])[NH:52][CH:53]([C:54](=[O:55])[OH:56])[c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[Cl:95][CH2:96][Cl:97].[K+:92].[K+:93].[K+:94].[P-:63]([F:64])([F:65])([F:66])([F:67])([F:68])[F:69].[P:87]([O-:88])([O-:89])([O-:90])=[O:91].[n:70]1([O:71][C:72]([N:73]([CH3:74])[CH3:75])=[N+:76]([CH3:77])[CH3:78])[c:79]2[n:80][cH:81][cH:82][cH:83][c:84]2[n:85][n:86]1>>[CH3:1][O:2][C:3]([NH:4][CH:5]([CH:6]([CH3:7])[CH3:8])[C:9](=[O:10])[N:11]1[CH:12]([c:16]2[nH:17][c:18](-[c:21]3[cH:22][c:23]4[cH:24][cH:25][c:26](-[c:31]5[cH:32][cH:33][c:34](-[c:37]6[nH:38][c:39]([CH:42]7[N:43]([C:54]([CH:53]([NH:52][C:50]([O:49][CH3:48])=[O:51])[c:57]8[cH:58][cH:59][cH:60][cH:61][cH:62]8)=[O:55])[CH2:44][CH2:45][CH2:46]7)[n:40][cH:41]6)[cH:35][cH:36]5)[cH:27][c:28]4[cH:29][cH:30]3)[cH:19][n:20]2)[CH2:13][CH2:14][CH2:15]1)=[O:47]

Participants

8

Reactant 7

HCID 813Potassium Cation3×HCID 1061PhosphateHCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 596264N-Methoxycarbonyl-2-phenylglycineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 66620477{2-Methyl-1-[2-(5-{6-[4-(2-pyrrolidin-2-yl-3H-imidazol-4-yl)-phenyl]-naphthalen-2-yl}-1H-imidazol-2-yl)-pyrrolidine-1-carbonyl]-propyl}-carbamic acid methyl ester

Product 1

HCID 76758776methyl N-[2-[2-[5-[4-[6-[2-[1-[2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]naphthalen-2-yl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamate

Sources & evidence

ORD record
ord-fcc7c9d5ef6647dbbd6797ef002d6b47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…