Methanesulfonic Acid → N-(2-Chloro-4-[(7-hydroxy-6-methoxy-4-quinazolinyl)oxy]phenyl}-N'-propylurea

HRID 2129437Notes

Reaction equation

HRID 2129437 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:34][CH3:35])[cH:11][c:12]2[c:13]([O:19][c:20]3[cH:21][c:22]([Cl:33])[c:23]([NH:26][C:27](=[O:28])[NH:29][CH2:30][CH2:31][CH3:32])[cH:24][cH:25]3)[n:14][cH:15][n:16][c:17]2[cH:18]1.[CH3:36][S:37](=[O:38])(=[O:39])[OH:40].[OH:41][C:42]([C:43]([F:44])([F:45])[F:46])=[O:47]>>[OH:8][c:9]1[c:10]([O:34][CH3:35])[cH:11][c:12]2[c:13]([O:19][c:20]3[cH:21][c:22]([Cl:33])[c:23]([NH:26][C:27](=[O:28])[NH:29][CH2:30][CH2:31][CH3:32])[cH:24][cH:25]3)[n:14][cH:15][n:16][c:17]2[cH:18]1

Participants

4

Reactant 3

HCID 6395Methanesulfonic AcidHCID 6422Trifluoroacetic acidHCID 22667035N-(4-{[7-(Benzyloxy)-6-methoxy-4-quinazolinyl]oxy}-2-chlorophenyl)-N'-propylurea

Product 1

HCID 135674214N-(2-Chloro-4-[(7-hydroxy-6-methoxy-4-quinazolinyl)oxy]phenyl}-N'-propylurea

Sources & evidence

ORD record
ord-0c5d1850e51444ef96ad37bc52ee7320
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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