2-METHYLSULFANYL-5-(4-NITROPHENYL)SULFANYLPYRIMIDINE-4-CARBOXYLIC ACID

CAS号
61727-09-1
CCD编号
CCD03037508
分子式
C12 H9 N3 O4 S2
分子量
323.352

基本信息

产品名称: 2-METHYLSULFANYL-5-(4-NITROPHENYL)SULFANYLPYRIMIDINE-4-CARBOXYLIC ACID
CAS: 61727-09-1
英文同义词: 2-METHYLSULFANYL-5-(4-NITROPHENYL)SULFANYLPYRIMIDINE-4-CARBOXYLIC ACID
MDL号: MFCD16657303
氢键受体数量: 7
氢键供体数量: 1
Smile: CSc1ncc(c(n1)C(=O)O)Sc2ccc(cc2)[N+](=O)[O-]
InChi: InChI=1S/C12H9N3O4S2/c1-20-12-13-6-9(10(14-12)11(16)17)21-8-4-2-7(3-5-8)15(18)19/h2-6H,1H3,(H,16,17)
InChiKey: InChIKey=BSTIKLVTIBQRBR-UHFFFAOYSA-N

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