HCID 66988923, compound → HCID 86659101, compound

HRID 2124316Notes

Reaction equation

HRID 2124316 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([NH:6][c:7]2[c:8]3[c:9]([c:10]([CH3:11])[cH:12][c:13]([S:14]([c:15]4[cH:16][cH:17][cH:18][c:19]([C:20](=[O:21])[NH:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH:30]=[O:31])[cH:32]4)(=[O:33])=[O:34])[cH:35]3)[n:36][cH:37][c:38]2[C:39]([NH2:40])=[O:41])[cH:42][cH:43][cH:44]1.[OH:45][CH2:46][c:47]1[cH:48][cH:49][c:50](-[c:53]2[cH:54][c:55]([S:59](=[O:60])(=[O:61])[c:62]3[cH:63][c:64]4[c:65]([NH:76][c:77]5[cH:78][c:79]([O:83][CH3:84])[cH:80][cH:81][cH:82]5)[c:66]([C:73](=[O:74])[NH2:75])[cH:67][n:68][c:69]4[c:70]([CH3:72])[cH:71]3)[cH:56][cH:57][cH:58]2)[cH:51][cH:52]1>>[O:45]=[CH:46][c:47]1[cH:48][cH:49][c:50](-[c:53]2[cH:54][c:55]([S:59](=[O:60])(=[O:61])[c:62]3[cH:63][c:64]4[c:65]([NH:76][c:77]5[cH:78][c:79]([O:83][CH3:84])[cH:80][cH:81][cH:82]5)[c:66]([C:73](=[O:74])[NH2:75])[cH:67][n:68][c:69]4[c:70]([CH3:72])[cH:71]3)[cH:56][cH:57][cH:58]2)[cH:51][cH:52]1

Participants

3

Reactant 2

HCID 66988923HCID 66988923, compoundHCID 866590914-[(3-Methoxyphenyl)amino]-8-methyl-6-[[3-[(8-oxooctyl)carbamoyl]phenyl]sulfonyl]quinoline-3-carboxamide

Product 1

HCID 86659101HCID 86659101, compound

Sources & evidence

ORD record
ord-c05a0ba2364f4d02853a1b4c2e103b85
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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