4-[[2-[(氨基羰基)氨基]-4-[(5-氯-2,6-二氟-4-嘧啶基)氨基]苯基]偶氮]-1,3-苯二磺酸钠盐

CAS号
83763-54-6
CCD编号
CCD08283447
分子式
C17 H10 Cl F2 N7 O7 S2 . 2 Na
分子量
607.869

基本信息

产品名称: 4-[[2-[(氨基羰基)氨基]-4-[(5-氯-2,6-二氟-4-嘧啶基)氨基]苯基]偶氮]-1,3-苯二磺酸钠盐
CAS: 83763-54-6
中文同义词: 4-[[2-[(氨基羰基)氨基]-4-[(5-氯-2,6-二氟嘧啶-4-基)氨基]苯基]偶氮]苯-1,3-二磺化钠 ; 4-[[2-[(氨基羰基)氨基]-4-[(5-氯-2,6-二氟-4-嘧啶基)氨基]苯基]偶氮]-1,3-苯二磺酸钠盐
英文同义词: SODIUM 4-[[2-[(AMINOCARBONYL)AMINO]-4-[(5-CHLORO-2,6-DIFLUOROPYRIMIDIN-4-YL)AMINO]PHENYL]AZO]BENZENE-1,3-DISULPHONATE ; DISODIUM 4-([2-(CARBAMOYLAMINO)-4-[(5-CHLORO-2,6-DIFLUORO-4-PYRIMIDINYL)AMINO]PHENYL]DIAZENYL)-1,3-BENZENEDISULFONATE
MDL号: MFCD23380008
氢键受体数量: 14
氢键供体数量: 3
Smile: c1cc(c(cc1Nc2c(c(nc(n2)F)F)Cl)NC(=O)N)/N=N/c3ccc(cc3S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]
InChi: InChI=1S/C17H12ClF2N7O7S2.2Na/c18-13-14(19)24-16(20)25-15(13)22-7-1-3-9(11(5-7)23-17(21)28)26-27-10-4-2-8(35(29,30)31)6-12(10)36(32,33)34;;/h1-6H,(H3,21,23,28)(H,22,24,25)(H,29,30,31)(H,32,33,34);;/q;2*+1/p-2/b27-26+;;
InChiKey: InChIKey=NKHYBWNQSRXAQY-YOYNBWDYSA-L

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