2-METHOXY-4-(2-(3-TOLUIDINOCARBOTHIOYL)CARBOHYDRAZONOYL)PHENYL 3-BROMOBENZOATE

CAS号
769152-24-1
CCD编号
CCD00487362
分子式
C23 H20 Br N3 O3 S
分子量
498.399

基本信息

产品名称: 2-METHOXY-4-(2-(3-TOLUIDINOCARBOTHIOYL)CARBOHYDRAZONOYL)PHENYL 3-BROMOBENZOATE
CAS: 769152-24-1
英文同义词: 2-METHOXY-4-(2-(3-TOLUIDINOCARBOTHIOYL)CARBOHYDRAZONOYL)PHENYL 3-BROMOBENZOATE
MDL号: MFCD05153566
氢键受体数量: 6
氢键供体数量: 2
Smile: Cc1cccc(c1)NC(=S)N/N=C/c2ccc(c(c2)OC)OC(=O)c3cccc(c3)Br
InChi: InChI=1S/C23H20BrN3O3S/c1-15-5-3-8-19(11-15)26-23(31)27-25-14-16-9-10-20(21(12-16)29-2)30-22(28)17-6-4-7-18(24)13-17/h3-14H,1-2H3,(H2,26,27,31)/b25-14+
InChiKey: InChIKey=KPKOAJRNOQEGRM-AFUMVMLFSA-N

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