基本信息 |
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产品名称: | 2-[[8-[[4-氯-6-[[4-(6-甲基-7-磺基-2-苯并噻唑基)苯基]氨基]-1,3,5-三嗪-2-基]氨基]-1-羟基-3,6-二磺基-2-萘基]偶氮]苯甲酸四钠盐 |
CAS: | 70209-93-7 |
中文同义词: | 2-[[8-[[4-氯-6-[[4-(6-甲基-7-磺基-2-苯并噻唑基)苯基]氨基]-1,3,5-三嗪-2-基]氨基]-1-羟基-3,6-二磺基-2-萘基]偶氮]苯甲酸四钠盐 |
英文同义词: | TETRASODIUM 2-[[8-[[4-CHLORO-6-[[4-(6-METHYL-7-SULPHONATOBENZOTHIAZOL-2-YL)PHENYL]AMINO]-1,3,5-TRIAZIN-2-YL]AMINO]-1-HYDROXY-3,6-BISULPHONATO-2-NAPHTHYL]AZO]BENZOATE |
MDL号: | MFCD23160557 |
氢键受体数量: | 20 |
氢键供体数量: | 3 |
Smile: | Cc1ccc2c(c1S(=O)(=O)[O-])sc(n2)c3ccc(cc3)Nc4nc(nc(n4)Cl)Nc5cc(cc6c5c(c(c(c6)S(=O)(=O)[O-])/N=N/c7ccccc7C(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+] |
InChi: | InChI=1S/C34H23ClN8O12S4.4Na/c1-15-6-11-22-28(29(15)59(53,54)55)56-30(37-22)16-7-9-18(10-8-16)36-33-39-32(35)40-34(41-33)38-23-14-19(57(47,48)49)12-17-13-24(58(50,51)52)26(27(44)25(17)23)43-42-21-5-3-2-4-20(21)31(45)46;;;;/h2-14,44H,1H3,(H,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55)(H2,36,38,39,40,41);;;;/q;4*+1/p-4/b43-42+;;;; |
InChiKey: | InChIKey=HMGBQRTWANMSHV-OCZBQVCASA-J |
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