3,5-DIIODO-2-[[[(1-OXOHEXYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

CAS号
533922-34-8
CCD编号
CCD00396670
分子式
C14 H16 I2 N2 O3 S
分子量
546.157

基本信息

产品名称: 3,5-DIIODO-2-[[[(1-OXOHEXYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 533922-34-8
英文同义词: 3,5-DIIODO-2-[[[(1-OXOHEXYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 3,5-DIIODO-2-[[[(1-OXOHEXYL)AMINO]THIOXOMETHYL]AMINO]-
MDL号: MFCD03569160
氢键受体数量: 5
氢键供体数量: 3
Smile: CCCCCC(=O)NC(=S)Nc1c(cc(cc1I)I)C(=O)O
InChi: InChI=1S/C14H16I2N2O3S/c1-2-3-4-5-11(19)17-14(22)18-12-9(13(20)21)6-8(15)7-10(12)16/h6-7H,2-5H2,1H3,(H,20,21)(H2,17,18,19,22)
InChiKey: InChIKey=UCGNRJIDYQWPEF-UHFFFAOYSA-N

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