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Chloride → 2-Cyclopropylamino-4-methyl-thiazole-5-carboxylic acid (cyano-thiophen-3-yl-methyl)-amide

HRID 1221737
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HRID 1221737 반응식
[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[CH:15]1([NH:16][c:17]2[s:18][c:19]([C:20]([OH:21])=[O:22])[c:23]([CH3:24])[n:25]2)[CH2:26][CH2:27]1.[CH:1]1([NH:4][c:5]2[s:6][c:7]([C:11](=[O:12])[OH:13])[c:8]([CH3:10])[n:9]2)[CH2:2][CH2:3]1.[Cl-:14].[Cl:28][P:29]([Cl:30])([Cl:31])([Cl:32])[Cl:33].[ClH:34].[NH2:35][CH:36]([C:37]#[N:38])[c:39]1[cH:40][s:41][cH:42][cH:43]1>>[CH:1]1([NH:4][c:5]2[s:6][c:7]([C:11](=[O:13])[NH:35][CH:36]([C:37]#[N:38])[c:39]3[cH:40][s:41][cH:42][cH:43]3)[c:8]([CH3:10])[n:9]2)[CH2:2][CH2:3]1
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반응물 6

HCID 312ChlorideHCID 313Hydrochloric AcidHCID 8471TriethylamineHCID 24819Phosphorus pentachlorideHCID 143294002-Amino-2-(thiophen-3-yl)acetonitrileHCID 224110622-(Cyclopropylamino)-4-methyl-1,3-thiazole-5-carboxylic acid2회

생성물 1

HCID 54398390
2-Cyclopropylamino-4-methyl-thiazole-5-carboxylic acid (cyano-thiophen-3-yl-methyl)-amide

출처 및 근거

ORD 기록
ord-e170c3ea54c94f34b021425119056b86
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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