Hydrochloric Acid → HCID 178425565, compound

HRID 1141182Notes

Reaction equation

HRID 1141182 reaction equation
[CH3:42][N+:43]([CH3:44])=[C:45]([N:46]([CH3:47])[CH3:48])[O:49][n:50]1[c:51]2[n:52][cH:53][cH:54][cH:55][c:56]2[n:57][n:58]1.[CH3:68][N:69]([CH3:70])[CH:71]=[O:72].[CH:59]([N:60]([CH2:61][CH3:62])[CH:63]([CH3:64])[CH3:65])([CH3:66])[CH3:67].[ClH:1].[F:18][C:19]([c:20]1[cH:21][c:22]2[c:23]([cH:31][cH:32]1)[O:24][CH:25]([C:28](=[O:29])[OH:30])[CH2:26][O:27]2)([F:33])[F:34].[NH2:2][CH:3]([CH3:4])[c:5]1[cH:6][c:7]([CH3:17])[c:8]([NH:12][S:13](=[O:14])(=[O:15])[CH3:16])[cH:9][c:10]1[F:11].[P-:35]([F:36])([F:37])([F:38])([F:39])([F:40])[F:41]>>[NH:2]([CH:3]([CH3:4])[c:5]1[cH:6][c:7]([CH3:17])[c:8]([NH:12][S:13](=[O:14])(=[O:15])[CH3:16])[cH:9][c:10]1[F:11])[C:28]([CH:25]1[O:24][c:23]2[c:22]([cH:21][c:20]([C:19]([F:18])([F:33])[F:34])[cH:32][cH:31]2)[O:27][CH2:26]1)=[O:29]

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 58118636N-[4-(1-amino-ethyl)-5-fluoro-2-methyl-phenyl]-methanesulfonamideHCID 668393906-(Trifluoromethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxylic acid

Product 1

HCID 178425565HCID 178425565, compound

Sources & evidence

ORD record
ord-f1dbd3ead52c4286937386d220832e99
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…