3-[3-(3-BROMO-4-ETHOXY-BENZOYL)-THIOUREIDO]-4-CHLORO-BENZOIC ACID

CAS号
532414-73-6
CCD编号
CCD00396733
分子式
C17 H14 Br Cl N2 O4 S
分子量
457.731

基本信息

产品名称: 3-[3-(3-BROMO-4-ETHOXY-BENZOYL)-THIOUREIDO]-4-CHLORO-BENZOIC ACID
CAS: 532414-73-6
英文同义词: ZERENEX E/8015491 ; 3-[[[(3-BROMO-4-ETHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-4-CHLORO-BENZOIC ACID ; 3-[3-(3-BROMO-4-ETHOXY-BENZOYL)-THIOUREIDO]-4-CHLORO-BENZOIC ACID ; BENZOIC ACID, 3-[[[(3-BROMO-4-ETHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-4-CHLORO-
MDL号: MFCD03569663
氢键受体数量: 6
氢键供体数量: 3
Smile: CCOc1ccc(cc1Br)C(=O)NC(=S)Nc2cc(ccc2Cl)C(=O)O
InChi: InChI=1S/C17H14BrClN2O4S/c1-2-25-14-6-4-9(7-11(14)18)15(22)21-17(26)20-13-8-10(16(23)24)3-5-12(13)19/h3-8H,2H2,1H3,(H,23,24)(H2,20,21,22,26)
InChiKey: InChIKey=UMRPGJWLYUZKCQ-UHFFFAOYSA-N

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