1-氨基-4-[[2-[[(5-氯-2,6-二氟-4-嘧啶基)氨基]甲基]-4-甲基-6-磺苯基]氨基]-9,10-二氢-9,10-二氧代-2-蒽磺酸二钠盐

CAS号
84100-74-3
CCD编号
CCD05228519
分子式
C26 H16 Cl F2 N5 O8 S2 . 2 Na
分子量
710.0

基本信息

产品名称: 1-氨基-4-[[2-[[(5-氯-2,6-二氟-4-嘧啶基)氨基]甲基]-4-甲基-6-磺苯基]氨基]-9,10-二氢-9,10-二氧代-2-蒽磺酸二钠盐
CAS: 84100-74-3
中文同义词: 1-氨基-4-[[2-[[(5-氯-2,6-二氟-4-嘧啶基)氨基]甲基]-4-甲基-6-磺苯基]氨基]-9,10-二氢-9,10-二氧代-2-蒽磺酸二钠盐
英文同义词: DISODIUM 1-AMINO-4-[[2-[[(5-CHLORO-2,6-DIFLUORO-PYRIMIDIN-4-YL)AMINO]METHYL]-4-METHYL-6-SULFONATOPHENYL]AMINO]-9,10-DIHYDRO-9,10-DIOXOANTHRACENE-2-SULFONATE
MDL号: MFCD19707345
氢键受体数量: 13
氢键供体数量: 3
Smile: Cc1cc(c(c(c1)S(=O)(=O)[O-])Nc2cc(c(c3c2C(=O)c4ccccc4C3=O)N)S(=O)(=O)[O-])CNc5c(c(nc(n5)F)F)Cl.[Na+].[Na+]
InChi: InChI=1S/C26H18ClF2N5O8S2.2Na/c1-10-6-11(9-31-25-19(27)24(28)33-26(29)34-25)21(16(7-10)44(40,41)42)32-14-8-15(43(37,38)39)20(30)18-17(14)22(35)12-4-2-3-5-13(12)23(18)36;;/h2-8,32H,9,30H2,1H3,(H,31,33,34)(H,37,38,39)(H,40,41,42);;/q;2*+1/p-2
InChiKey: InChIKey=BZDOIRTYNHIAPB-UHFFFAOYSA-L

* If the product has intellectual property rights, a license granted is must or contact us.