Methanol → HCID 57565215, compound

HRID 122446Notes

Reaction equation

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

Participants

Reactant 5

HCID 887Methanol

HCID 961Hydroxide

HCID 8028Tetrahydrofuran

HCID 28486Lithium ion

HCID 57565241{6-Methoxy-7-[4-(5-trifluoromethyl-pyridin-2-yl)-piperazine-1-sulfonyl]-benzo[b]thiophen-3-yl}-acetic acid ethyl ester

Product 1

HCID 57565215HCID 57565215, compound

Sources & evidence

ORD record: ord-7137079929de4251a9a260be6344d346
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…