N-[[18-[2-[4-(isopropyl)thiazol-2-yl]-7-methoxyquinolin-4-yloxy]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-en-4-yl]carbonyl](cyclopropyl)sulfonamide → N-[18-[2-(4-isopropylthiazol-2-yl)-7-methoxy-8-methylquinolin-4-yloxy]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carbonyl](cyclopropyl)sulfonamide
Reaction equation
[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][c:6](-[c:9]2[n:10][c:11]3[c:12]([CH3:46])[c:13]([O:44][CH3:45])[cH:14][cH:15][c:16]3[c:17]([O:19][CH:20]3[CH2:21][N:22]4[C:23](=[O:43])[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH:30]=[CH:31][CH:32]5[CH2:33][C:34]5([C:40](=[O:41])[OH:42])[NH:35][C:36](=[O:39])[CH:37]4[CH2:38]3)[cH:18]2)[s:7][cH:8]1.[CH:47]([c:48]1[n:49][c:50](-[c:51]2[cH:52][c:53]([O:54][CH:55]3[CH2:56][CH:57]4[N:58]([C:59](=[O:60])[CH2:61][CH2:62][CH2:63][CH2:64][CH2:65][CH2:66][CH:67]=[CH:68][CH:69]5[C:70]([C:71](=[O:72])[NH:88][S:89](=[O:90])(=[O:91])[CH:92]6[CH2:93][CH2:94]6)([NH:73][C:74]4=[O:75])[CH2:76]5)[CH2:77]3)[c:78]3[c:79]([cH:80][c:81]([O:82][CH3:83])[cH:84][cH:85]3)[n:86]2)[s:87][cH:95]1)([CH3:96])[CH3:97]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][c:6](-[c:9]2[n:10][c:11]3[c:12]([CH3:46])[c:13]([O:44][CH3:45])[cH:14][cH:15][c:16]3[c:17]([O:19][CH:20]3[CH2:21][N:22]4[C:23](=[O:43])[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH:30]=[CH:31][CH:32]5[CH2:33][C:34]5([C:40](=[O:41])[NH:88][S:89](=[O:90])(=[O:91])[CH:92]5[CH2:93][CH2:94]5)[NH:35][C:36](=[O:39])[CH:37]4[CH2:38]3)[cH:18]2)[s:7][cH:8]1Participants
3
Reactant 2
HCID 67318810N-[[18-[2-[4-(isopropyl)thiazol-2-yl]-7-methoxyquinolin-4-yloxy]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-en-4-yl]carbonyl](cyclopropyl)sulfonamide
HCID 6731895918-[2-(4-Isopropylthiazol-2-yl)-7-methoxy-8-methylquinolin-4-yloxy]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acidProduct 1
Sources & evidence
- ORD record
- ord-fd187324938548f4a819c6d528978f71
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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