BU 4-((((2,2,2-TRI-CL-1-((2-ME-BENZOYL)AMINO)ET)AMINO)CARBOTHIOYL)AMINO)BENZOATE

CAS号
406915-75-1
CCD编号
CCD00146844
分子式
C22 H24 Cl3 N3 O3 S
分子量
516.875

基本信息

产品名称: BU 4-((((2,2,2-TRI-CL-1-((2-ME-BENZOYL)AMINO)ET)AMINO)CARBOTHIOYL)AMINO)BENZOATE
CAS: 406915-75-1
英文同义词: BU 4-((((2,2,2-TRI-CL-1-((2-ME-BENZOYL)AMINO)ET)AMINO)CARBOTHIOYL)AMINO)BENZOATE
MDL号: MFCD00648657
氢键受体数量: 6
氢键供体数量: 3
Smile: CCCCOC(=O)c1ccc(cc1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)c2ccccc2C
InChi: InChI=1S/C22H24Cl3N3O3S/c1-3-4-13-31-19(30)15-9-11-16(12-10-15)26-21(32)28-20(22(23,24)25)27-18(29)17-8-6-5-7-14(17)2/h5-12,20H,3-4,13H2,1-2H3,(H,27,29)(H2,26,28,32)
InChiKey: InChIKey=SDTJIRCXSPOXER-UHFFFAOYSA-N

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