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Bicarbonate Ion → 2-Amino-4-(2-bromo-1,3-thiazol-4-yl)-6-({[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)pyridine-3,5-dicarbonitrile

HRID 2330594
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HRID 2330594 반응식
[C:33](=[O:34])([OH:35])[O-:36].[Cl:19][CH2:20][c:21]1[n:22][c:23](-[c:26]2[cH:27][cH:28][c:29]([Cl:32])[cH:30][cH:31]2)[s:24][cH:25]1.[NH2:1][c:2]1[n:3][c:4]([SH:18])[c:5]([C:16]#[N:17])[c:6](-[c:10]2[n:11][c:12]([Br:15])[s:13][cH:14]2)[c:7]1[C:8]#[N:9].[Na+:37].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[OH2:38]>>[NH2:1][c:2]1[n:3][c:4]([S:18][CH2:20][c:21]2[n:22][c:23](-[c:26]3[cH:27][cH:28][c:29]([Cl:32])[cH:30][cH:31]3)[s:24][cH:25]2)[c:5]([C:16]#[N:17])[c:6](-[c:10]2[n:11][c:12]([Br:15])[s:13][cH:14]2)[c:7]1[C:8]#[N:9]
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참가 물질

7

반응물 6

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 6228DimethylformamideHCID 6102974-(Chloromethyl)-2-(4-chlorophenyl)-1,3-thiazoleHCID 178510491HCID 178510491, 화합물

생성물 1

HCID 66897973
2-Amino-4-(2-bromo-1,3-thiazol-4-yl)-6-({[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)pyridine-3,5-dicarbonitrile

출처 및 근거

ORD 기록
ord-d638f8726389498d957817e508d303d6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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