Hydrochloric Acid → 2-(3-Methoxy-4-pyrrolidin-3-yl-benzenesulfonyl)-benzonitrile

HRID 699344Notes

Reaction equation

HRID 699344 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH:10]([c:13]2[c:14]([O:30][CH3:31])[cH:15][c:16]([S:19](=[O:20])(=[O:21])[c:22]3[c:23]([C:28]#[N:29])[cH:24][cH:25][cH:26][cH:27]3)[cH:17][cH:18]2)[CH2:11][CH2:12]1)([CH3:5])([CH3:6])[CH3:7].[CH2:33]1[O:34][CH2:35][CH2:36][O:37][CH2:38]1.[ClH:32]>>[NH:8]1[CH2:9][CH:10]([c:13]2[c:14]([O:30][CH3:31])[cH:15][c:16]([S:19](=[O:20])(=[O:21])[c:22]3[c:23]([C:28]#[N:29])[cH:24][cH:25][cH:26][cH:27]3)[cH:17][cH:18]2)[CH2:11][CH2:12]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 594283263-[4-(2-Cyano-benzenesulfonyl)-2-methoxy-phenyl]-pyrrolidine-1-carboxylic acid tert-butyl ester

Product 1

HCID 249841662-(3-Methoxy-4-pyrrolidin-3-yl-benzenesulfonyl)-benzonitrile

Sources & evidence

ORD record
ord-e0de5853cf4a4212b2c96acdbe7addc1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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