3,5-DIIODO-2-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

CAS号
531542-13-9
CCD编号
CCD00396451
分子式
C19 H18 I2 N2 O4 S
分子量
624.227

基本信息

产品名称: 3,5-DIIODO-2-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 531542-13-9
英文同义词: BENZOIC ACID, 3,5-DIIODO-2-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]- ; 3,5-DIIODO-2-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
MDL号: MFCD03567271
氢键受体数量: 6
氢键供体数量: 3
Smile: CC(C)COc1ccc(cc1)C(=O)NC(=S)Nc2c(cc(cc2I)I)C(=O)O
InChi: InChI=1S/C19H18I2N2O4S/c1-10(2)9-27-13-5-3-11(4-6-13)17(24)23-19(28)22-16-14(18(25)26)7-12(20)8-15(16)21/h3-8,10H,9H2,1-2H3,(H,25,26)(H2,22,23,24,28)
InChiKey: InChIKey=VQRLROUMGQSXHW-UHFFFAOYSA-N

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