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2-(4-methylphenyl)sulfonyl-1H-isoquinoline-1-carbonitrile

更新时间:2025-08-26 15:55:27

2-(4-methylphenyl)sulfonyl-1H-isoquinoline-1-carbonitrile结构式
2-(4-methylphenyl)sulfonyl-1H-isoquinoline-1-carbonitrile结构式
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常用名 2-(4-methylphenyl)sulfonyl-1H-isoquinoline-1-carbonitrile 英文名 2-(4-methylphenyl)sulfonyl-1H-isoquinoline-1-carbonitrile
CAS号 3340-68-9 分子量 310.37000
密度 1.37g/cm3 沸点 545.8ºC at 760 mmHg
分子式 C17H14N2O2S 熔点 N/A
MSDS N/A 闪点 283.9ºC

 名称

英文名 2-(4-methylphenyl)sulfonyl-1H-isoquinoline-1-carbonitrile
英文别名 更多

 物理化学性质

密度 1.37g/cm3
沸点 545.8ºC at 760 mmHg
分子式 C17H14N2O2S
分子量 310.37000
闪点 283.9ºC
精确质量 310.07800
PSA 69.55000
LogP 4.25358
InChIKey XDAMNXBOSSTXSW-UHFFFAOYSA-N
SMILES Cc1ccc(S(=O)(=O)N2C=Cc3ccccc3C2C#N)cc1
折射率 1.676

 安全信息

海关编码 2933499090

 合成线路

~58%

2-(4-methylphenyl)sulfonyl-1H-isoquinoline-1-carbonitrile结构式

2-(4-methylphen...

3340-68-9

文献:Chenevert, Robert; Lemieux, Even; Voyer, Normand Synthetic Communications, 1983 , vol. 13, # 13 p. 1095 - 1102

 海关

海关编码 2933499090
中文概述 2933499090. 其他含喹琳或异喹啉环系的化合物〔但未进一步稠合的〕. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素 品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
Summary 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 靶点实验

查看更多实验

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来源:11812
靶标:N/A
External Id:FATTTLab-Algae-Lipid
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来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:HCMV UL50
External Id:HMS1262
实验名称:Dicer-mediated maturation of pre-microRNA
来源:Center for Chemical Genomics, University of Michigan
靶标:N/A
External Id:TargetID_659_CEMA
实验名称:Small-molecule inhibitors of ST2 (IL1RL1)
来源:20881
靶标:interleukin-1 receptor-like 1 isoform [homo sapiens]
External Id:ST2_IL33_Inhibitors_Primary_Screening_77700
实验名称:Inhibitors of CDC25B-CDK2/CyclinA interaction
来源:Center for Chemical Genomics, University of Michigan
External Id:MScreen:TargetID_600
实验名称:Alphascreen assay for small molecules abrogating mHTT-CaM Interaction
来源:24983
靶标:Huntingtin
External Id:KUHTS-Muma KU-CaM-Htt INH-01
实验名称:Cell-based high throughput primary assay to identify activators of GPR151
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id:GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
实验名称:AlphaScreen-based biochemical high throughput primary assay to identify activators of...
来源:The Scripps Research Institute Molecular Screening Center
靶标:N/A
External Id:FBW7_ACT_ALPHA_1536_1X%ACT PRUN
实验名称:AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
来源:The Scripps Research Institute Molecular Screening Center
External Id:MITF_INH_Alpha_1536_1X%INH PRUN
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 英文别名

2-p-Tolylsulfonyl-1,2-dihydro-isochinolin-carbonsaeure-(1)-nitril
N-(p-Toluenesulfonyl)-1,2-dihydroisoquinaldonitrile
2-(Toluene-4-sulfonyl)-1,2-dihydro-isoquinoline-1-carbonitrile
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