Chloroform → HCID 22507726, compound

HRID 1132817Notes

Reaction equation

HRID 1132817 reaction equation
[CH2:43]([N:44]([CH:45]([CH3:46])[CH3:47])[CH:48]([CH3:49])[CH3:50])[CH3:51].[CH2:70]1[O:71][CH2:72][CH2:73][CH2:74]1.[Cl:75][CH:76]([Cl:77])[Cl:78].[O:1]=[C:2]1[N:3]([CH2:7][CH2:8][O:9][c:10]2[cH:11][c:12]([C:13](=[O:14])[OH:15])[cH:16][cH:17][n:18]2)[CH2:4][CH2:5][CH2:6]1.[O:52]1[CH:53]([c:58]2[cH:59][cH:60][c:61]([O:68][CH3:69])[c:62]3[n:63][c:64]([NH2:67])[s:65][c:66]23)[CH2:54][O:55][CH2:56][CH2:57]1.[P-:19]([F:20])([F:21])([F:22])([F:23])([F:24])[F:25].[n:26]1([O:27][C:28]([N:29]([CH3:30])[CH3:31])=[N+:32]([CH3:33])[CH3:34])[c:35]2[n:36][cH:37][cH:38][cH:39][c:40]2[n:41][n:42]1>>[O:1]=[C:2]1[N:3]([CH2:7][CH2:8][O:9][c:10]2[cH:11][c:12]([C:13](=[O:15])[NH:67][c:64]3[n:63][c:62]4[c:61]([O:68][CH3:69])[cH:60][cH:59][c:58]([CH:53]5[O:52][CH2:57][CH2:56][O:55][CH2:54]5)[c:66]4[s:65]3)[cH:16][cH:17][n:18]2)[CH2:4][CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 6212ChloroformHCID 8028TetrahydrofuranHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 22507697(+)-7-[1,4)Dioxan-2-yl-4-methoxy-benzothiazol-2-ylamineHCID 22507716HCID 22507716, compound

Product 1

HCID 22507726HCID 22507726, compound

Sources & evidence

ORD record
ord-ea406a13c4294e06b807625e391219ac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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