Acetonitrile → 5,10-Dihydro-5-[[2-[2-(dimethylamino)ethyl]-1-piperidinyl]-acetyl]-11H-dibenzo[b,e][1,4]diazepin-11-one

HRID 665854

반응식

HRID 665854 반응식
[CH3:21][N:22]([CH2:23][CH2:24][CH:25]1[NH:26][CH2:27][CH2:28][CH2:29][CH2:30]1)[CH3:31].[CH3:32][C:33]#[N:34].[Cl:1][CH2:2][C:3](=[O:4])[N:5]1[c:6]2[c:7]([cH:17][cH:18][cH:19][cH:20]2)[NH:8][C:9](=[O:16])[c:10]2[c:11]1[cH:12][cH:13][cH:14][cH:15]2>>[CH2:2]([C:3](=[O:4])[N:5]1[c:6]2[c:7]([cH:17][cH:18][cH:19][cH:20]2)[NH:8][C:9](=[O:16])[c:10]2[c:11]1[cH:12][cH:13][cH:14][cH:15]2)[N:26]1[CH:25]([CH2:24][CH2:23][N:22]([CH3:21])[CH3:31])[CH2:30][CH2:29][CH2:28][CH2:27]1

참가 물질

4

반응물 3

HCID 6342AcetonitrileHCID 296295Dimethyl-(2-piperidin-2-yl-ethyl)-amineHCID 100854195-(chloroacetyl)-5,10-dihydro-11H-dibenzo[b,e][1,4]diazepin-11-one

생성물 1

HCID 135785595,10-Dihydro-5-[[2-[2-(dimethylamino)ethyl]-1-piperidinyl]-acetyl]-11H-dibenzo[b,e][1,4]diazepin-11-one

출처 및 근거

ORD 기록
ord-addd62f491b84213bfab7376103906d5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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