4-[3-[(4-ISOPROPYLPHENYL)THIO]-6-OXOPYRIDAZIN-1(6H)-YL]BENZOIC ACID

CAS号
CCD编号
CCD03264165
分子式
C20 H18 N2 O3 S
分子量
366.439

基本信息

产品名称: 4-[3-[(4-ISOPROPYLPHENYL)THIO]-6-OXOPYRIDAZIN-1(6H)-YL]BENZOIC ACID
英文同义词: 4-[3-[(4-ISOPROPYLPHENYL)THIO]-6-OXOPYRIDAZIN-1(6H)-YL]BENZOIC ACID
MDL号: MFCD16992452
氢键受体数量: 5
氢键供体数量: 1
Smile: CC(C)c1ccc(cc1)Sc2ccc(=O)n(n2)c3ccc(cc3)C(=O)O
InChi: InChI=1S/C20H18N2O3S/c1-13(2)14-5-9-17(10-6-14)26-18-11-12-19(23)22(21-18)16-7-3-15(4-8-16)20(24)25/h3-13H,1-2H3,(H,24,25)
InChiKey: InChIKey=FYDUQVLNLOILDK-UHFFFAOYSA-N

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