Hydrochloric Acid → HCID 72446513, compound

HRID 1201215Notes

Reaction equation

HRID 1201215 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([C:11]([C:12](=[O:13])[OH:14])=[CH:15][c:16]2[s:17][cH:18][cH:19][cH:20]2)[cH:9][cH:10]1.[CH:53]([N:54]([CH2:55][CH3:56])[CH:57]([CH3:58])[CH3:59])([CH3:60])[CH3:61].[Cl:46][c:47]1[cH:48][n:49][c:50]([NH2:52])[s:51]1.[ClH:45].[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[P-:21]([F:22])([F:23])([F:24])([F:25])([F:26])[F:27].[n:28]1([O:29][C:30]([N:31]([CH3:32])[CH3:33])=[N+:34]([CH3:35])[CH3:36])[c:37]2[n:38][cH:39][cH:40][cH:41][c:42]2[n:43][n:44]1>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([C:11]([C:12](=[O:14])[NH:52][c:50]2[n:49][cH:48][c:47]([Cl:46])[s:51]2)=[CH:15][c:16]2[s:17][cH:18][cH:19][cH:20]2)[cH:9][cH:10]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 389422-Amino-5-chlorothiazoleHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 67486942HCID 67486942, compound

Product 1

HCID 72446513HCID 72446513, compound

Sources & evidence

ORD record
ord-01822e0a92ff40b4bde9b26b912c7d1f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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