Tetrahydrofuran → 1-(2,4-dichlorophenyl)-3-(1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-3-yl)urea

反応式

[Cl:1][c:2]1[c:3]([N:9]=[C:10]=[O:11])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[NH2:12][CH:13]1[C:14](=[O:31])[N:15]([CH3:30])[c:16]2[c:17]([cH:26][cH:27][cH:28][cH:29]2)[C:18]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)=[N:19]1.[O:32]1[CH2:33][CH2:34][CH2:35][CH2:36]1>>[Cl:1][c:2]1[c:3]([NH:9][C:10](=[O:11])[NH:12][CH:13]2[C:14](=[O:31])[N:15]([CH3:30])[c:16]3[c:17]([cH:26][cH:27][cH:28][cH:29]3)[C:18]([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)=[N:19]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1

参加物

反応物 3

HCID 8028Tetrahydrofuran

HCID 757892,4-Dichlorophenyl isocyanate

HCID 27296813-Amino-1-methyl-5-phenyl-1H-benzo[E][1,4]diazepin-2(3H)-one

生成物 1

HCID 102533661-(2,4-dichlorophenyl)-3-(1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-3-yl)urea

出典と根拠

ORDレコード: ord-5e5a9c2c709842d48349deab80e424f5
出典データセット: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

反応ノート

読み込み中…