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Benzene → N-[(3-{1-[(cyclopropylmethyl)amino]-4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl}-1,1-dioxido-4H-thieno[2,3-e][1,2,4]thiadiazin-7-yl)methyl]benzenesulfonamide

HRID 148129
Notes
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Reaction equation

HRID 148129 reaction equation
[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[NH2:1][CH2:2][c:3]1[cH:4][s:5][c:6]2[c:11]1[S:10](=[O:12])(=[O:13])[N:9]=[C:8]([c:14]1[c:15](=[O:30])[n:16]([NH:25][CH2:26][CH:27]3[CH2:28][CH2:29]3)[c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]3[c:23]1[OH:24])[NH:7]2.[S:38](=[O:39])(=[O:40])([Cl:41])[Cl:42].[cH:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[NH:1]([CH2:2][c:3]1[cH:4][s:5][c:6]2[c:11]1[S:10](=[O:12])(=[O:13])[N:9]=[C:8]([c:14]1[c:15](=[O:30])[n:16]([NH:25][CH2:26][CH:27]3[CH2:28][CH2:29]3)[c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]3[c:23]1[OH:24])[NH:7]2)[S:38](=[O:39])(=[O:40])[c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 241BenzeneHCID 6228DimethylformamideHCID 8471TriethylamineHCID 24648Sulfuryl chlorideHCID 1363584943-[7-(aminomethyl)-1,1-dioxido-4H-thieno[2,3-e][1,2,4]thiadiazin-3-yl]-1-[(cyclopropylmethyl)amino]-4-hydroxyquinolin-2(1H)-one

Product 1

HCID 136358514
N-[(3-{1-[(cyclopropylmethyl)amino]-4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl}-1,1-dioxido-4H-thieno[2,3-e][1,2,4]thiadiazin-7-yl)methyl]benzenesulfonamide

Sources & evidence

ORD record
ord-0bef9456462f4e20bbb3dc914420a7fc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes