5-BROMO-2-[[[[3-(3,5-DIBROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

CAS号
532979-64-9
CCD编号
CCD00396856
分子式
C18 H13 Br3 N2 O4 S
分子量
593.089

基本信息

产品名称: 5-BROMO-2-[[[[3-(3,5-DIBROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 532979-64-9
英文同义词: 5-BROMO-2-[[[[3-(3,5-DIBROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 5-BROMO-2-[[[[3-(3,5-DIBROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-
MDL号: MFCD03570635
氢键受体数量: 6
氢键供体数量: 3
Smile: COc1c(cc(cc1Br)Br)/C=C/C(=O)NC(=S)Nc2ccc(cc2C(=O)O)Br
InChi: InChI=1S/C18H13Br3N2O4S/c1-27-16-9(6-11(20)8-13(16)21)2-5-15(24)23-18(28)22-14-4-3-10(19)7-12(14)17(25)26/h2-8H,1H3,(H,25,26)(H2,22,23,24,28)/b5-2+
InChiKey: InChIKey=CPRXDJYORRPDQY-GORDUTHDSA-N

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