Chloroform → HCID 22507704, compound

HRID 1130375Notes

Reaction equation

HRID 1130375 reaction equation
[CH2:35]([N:36]([CH:37]([CH3:38])[CH3:39])[CH:40]([CH3:41])[CH3:42])[CH3:43].[CH2:62]1[O:63][CH2:64][CH2:65][CH2:66]1.[CH3:1][N:2]([C:3]([CH2:4][CH2:5][C:6](=[O:7])[OH:8])=[O:9])[CH3:10].[Cl:67][CH:68]([Cl:69])[Cl:70].[O:44]1[CH:45]([c:50]2[cH:51][cH:52][c:53]([O:60][CH3:61])[c:54]3[n:55][c:56]([NH2:59])[s:57][c:58]23)[CH2:46][O:47][CH2:48][CH2:49]1.[P-:11]([F:12])([F:13])([F:14])([F:15])([F:16])[F:17].[n:18]1([O:19][C:20]([N:21]([CH3:22])[CH3:23])=[N+:24]([CH3:25])[CH3:26])[c:27]2[n:28][cH:29][cH:30][cH:31][c:32]2[n:33][n:34]1>>[CH3:1][N:2]([C:3]([CH2:4][CH2:5][C:6](=[O:8])[NH:59][c:56]1[n:55][c:54]2[c:53]([O:60][CH3:61])[cH:52][cH:51][c:50]([CH:45]3[O:44][CH2:49][CH2:48][O:47][CH2:46]3)[c:58]2[s:57]1)=[O:9])[CH3:10]

Participants

8

Reactant 7

HCID 6212ChloroformHCID 8028TetrahydrofuranHCID 9886HexafluorophosphateHCID 75717Butanoic acid, 4-(dimethylamino)-4-oxo-HCID 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-ylamine

Product 1

HCID 22507704HCID 22507704, compound

Sources & evidence

ORD record
ord-542baff2ee40411b8d1934c0635a0881
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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