Hydrochloric Acid → Methyl 4-{[(2-{1-[5-(3,4-dichlorophenyl)-4-hydroxy-1-methyl-1H-pyrazol-3-yl]ethylidene}hydrazino)-carbonothioyl]amino}-2-nitrobenzoate

HRID 286587ノート

反応式

HRID 286587 の反応式
[CH3:1][N:2]([CH3:3])[CH:4]=[O:5].[Cl:7][c:8]1[cH:9][c:10](-[c:15]2[c:16]([OH:24])[c:17]([C:21]([CH3:22])=[O:23])[n:18][n:19]2[CH3:20])[cH:11][cH:12][c:13]1[Cl:14].[ClH:6].[NH:25]([NH2:26])[C:27](=[S:28])[NH:29][c:30]1[cH:31][c:32]([N+:40](=[O:41])[O-:42])[c:33]([C:34](=[O:35])[O:36][CH3:37])[cH:38][cH:39]1.[OH2:43]>>[Cl:7][c:8]1[cH:9][c:10](-[c:15]2[c:16]([OH:24])[c:17]([C:21]([CH3:22])=[N:26][NH:25][C:27](=[S:28])[NH:29][c:30]3[cH:31][c:32]([N+:40](=[O:41])[O-:42])[c:33]([C:34](=[O:35])[O:36][CH3:37])[cH:38][cH:39]3)[n:18][n:19]2[CH3:20])[cH:11][cH:12][c:13]1[Cl:14]

参加物

6

反応物 5

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 60206780HCID 60206780、化合物HCID 86014590Methyl 4-hydrazinocarbonothioylamino-2-nitrobenzoate

生成物 1

HCID 72360033Methyl 4-{[(2-{1-[5-(3,4-dichlorophenyl)-4-hydroxy-1-methyl-1H-pyrazol-3-yl]ethylidene}hydrazino)-carbonothioyl]amino}-2-nitrobenzoate

出典と根拠

ORDレコード
ord-a7c8a28075cc42b1907370663aa38168
出典データセット
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反応ノート

読み込み中…