Dimethyl Sulfoxide → HCID 178463456, compound

HRID 143504Notes

Reaction equation

HRID 143504 reaction equation
[CH3:81][S:82]([CH3:83])=[O:84].[CH:54]([N:55]([CH:56]([CH3:57])[CH3:58])[CH2:59][CH3:60])([CH3:61])[CH3:62].[CH:63]([c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1)([c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1)[CH:76]1[NH:77][CH2:78][CH2:79][CH2:80]1.[Cl:1][c:2]1[cH:3][c:4]2[c:5]([NH:15][CH:16]([CH3:17])[c:18]3[n:19][c:20]4[c:21]([nH:22]3)[cH:23][cH:24][c:25]([Cl:27])[cH:26]4)[n:6][cH:7][n:8][c:9]2[cH:10][c:11]1[C:12](=[O:13])[OH:14].[F:35][CH:36]([F:37])[N+:38]([C:39]([F:40])([F:41])[F:42])=[C:43]([N:44]([c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1)[CH3:51])[O:52][CH3:53].[P-:28]([F:29])([F:30])([F:31])([F:32])([F:33])[F:34]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([NH:15][CH:16]([CH3:17])[c:18]3[n:19][c:20]4[c:21]([nH:22]3)[cH:23][cH:24][c:25]([Cl:27])[cH:26]4)[n:6][cH:7][n:8][c:9]2[cH:10][c:11]1[C:12](=[O:13])[N:77]1[CH:76]([CH:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[CH2:80][CH2:79][CH2:78]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 12952-(Diphenylmethyl)pyrrolidineHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 86594256difluoromethyl-[methoxy-(N-methylanilino)methylidene]-(trifluoromethyl)azaniumHCID 1784635046-chloro-4-(1-(5-chloro-1H-benzimidazol-2-yl)-ethylamino]-7-hydroxycarbonyl-quinazoline

Product 1

HCID 178463456HCID 178463456, compound

Sources & evidence

ORD record
ord-fa76a1d278ac44b68c64c9b5fdac148b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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