Dichloromethane → HCID 46909184, compound

HRID 160645Notes

Reaction equation

HRID 160645 reaction equation
[C:62]([CH3:63])([CH3:64])([CH3:65])[NH:66][CH2:67][c:68]1[cH:69][c:70]2[c:75]([cH:76][cH:77]1)[CH2:74][CH:73]([NH2:78])[CH2:72][CH2:71]2.[CH3:1][O:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8]([S:13](=[O:14])(=[O:15])[N:16]3[CH:17]([CH2:25][C:26](=[O:27])[OH:28])[c:18]4[n:19]([cH:22][cH:23][cH:24]4)[CH2:20][CH2:21]3)[cH:9][c:10]2[cH:11][cH:12]1.[CH:53]([N:54]([CH2:55][CH3:56])[CH:57]([CH3:58])[CH3:59])([CH3:60])[CH3:61].[Cl:79][CH2:80][Cl:81].[P-:29]([F:30])([F:31])([F:32])([F:33])([F:34])[F:35].[n:36]1([O:37][C:38]([N:39]([CH3:40])[CH3:41])=[N+:42]([CH3:43])[CH3:44])[c:45]2[n:46][cH:47][cH:48][cH:49][c:50]2[n:51][n:52]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8]([S:13](=[O:14])(=[O:15])[N:16]3[CH:17]([CH2:25][C:26](=[O:28])[NH:78][CH:73]4[CH2:72][CH2:71][c:70]5[cH:69][c:68]([CH2:67][NH:66][C:62]([CH3:63])([CH3:64])[CH3:65])[cH:77][cH:76][c:75]5[CH2:74]4)[c:18]4[n:19]([cH:22][cH:23][cH:24]4)[CH2:20][CH2:21]3)[cH:9][c:10]2[cH:11][cH:12]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 594864212-(2-(6-Methoxynaphthalen-2-ylsulfonyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-1-yl)acetic acidHCID 59486444HCID 59486444, compound

Product 1

HCID 46909184HCID 46909184, compound

Sources & evidence

ORD record
ord-acbbda3fbdaa4e8ca363d0556966b818
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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