Dimethylformamide → (1RS,3aSR,6aRS)-4-(5-benzyl-2,3,3-trimethyl-4,6-dioxo-octahydro-pyrrolo[3,4-c]pyrrol-1-ylmethyl)-benzonitrile

반응식

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

참가 물질

반응물 3

HCID 6228Dimethylformamide

HCID 69953772(3aRS,4RS,6aSR)-2-benzyl-4-(4-bromobenzyl)-5,6,6-trimethyl-tetrahydro-pyrrolo[3,4-c]pyrrole-1,3-dione

HCID 178418546HCID 178418546, 화합물

생성물 1

HCID 69954349(1RS,3aSR,6aRS)-4-(5-benzyl-2,3,3-trimethyl-4,6-dioxo-octahydro-pyrrolo[3,4-c]pyrrol-1-ylmethyl)-benzonitrile

출처 및 근거

ORD 기록: ord-9610abc804e347fd8f2215a6fcfbdabc
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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