基本信息 |
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产品名称: | 1-ACETYL-N,N'-BIS(2-CHLORO-6-FLUOROBENZYL)-1H-1,2,4-TRIAZOLE-3,5-DIAMINE |
CAS: | 838812-42-3 |
英文同义词: | C2BA-13 ; 1-ACETYL-N,N'-BIS(2-CHLORO-6-FLUOROBENZYL)-1H-1,2,4-TRIAZOLE-3,5-DIAMINE |
MDL号: | MFCD06632244 |
氢键受体数量: | 6 |
氢键供体数量: | 2 |
Smile: | CC(=O)n1c(nc(n1)NCc2c(cccc2Cl)F)NCc3c(cccc3Cl)F |
InChi: | InChI=1S/C18H15Cl2F2N5O/c1-10(28)27-18(24-9-12-14(20)5-3-7-16(12)22)25-17(26-27)23-8-11-13(19)4-2-6-15(11)21/h2-7H,8-9H2,1H3,(H2,23,24,25,26) |
InChiKey: | InChIKey=WPIJCIBKIMSYMI-UHFFFAOYSA-N |
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