Acetonitrile → 5-Phenyl-1-(2-thienylsulfonyl)-1H-pyrrole-3-carbaldehyde

Reaction equation

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

Participants

Reactant 4

HCID 6342Acetonitrile

HCID 8857Ethyl Acetate

HCID 82029Methyl morpholine oxide

HCID 66924716[5-Phenyl-1-(2-thienylsulfonyl)-1H-pyrrol-3-yl]methanol

Product 1

HCID 862328445-Phenyl-1-(2-thienylsulfonyl)-1H-pyrrole-3-carbaldehyde

Sources & evidence

ORD record: ord-992c764f704f4edd922f53cd2aecdbb9
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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