BETA-ALANINE, N-[4-[[[4-(4-CHLOROPHENYL)-2-THIAZOLYL][4-(TRIFLUOROMETHYL)PHENYL]AMINO]METHYL]BENZOYL]-

CAS号
643011-22-7
CCD编号
CCD02956604
分子式
C27 H21 Cl F3 N3 O3 S
分子量
559.994

基本信息

产品名称: BETA-ALANINE, N-[4-[[[4-(4-CHLOROPHENYL)-2-THIAZOLYL][4-(TRIFLUOROMETHYL)PHENYL]AMINO]METHYL]BENZOYL]-
CAS: 643011-22-7
英文同义词: BETA-ALANINE, N-[4-[[[4-(4-CHLOROPHENYL)-2-THIAZOLYL][4-(TRIFLUOROMETHYL)PHENYL]AMINO]METHYL]BENZOYL]- ; N-[4-[[[4-(4-CHLOROPHENYL)-2-THIAZOLYL]-[4-(TRIFLUOROMETHYL)PHENYL]AMINO]METHYL]BENZOYL]BETA-ALANINE
MDL号: MFCD16495782
氢键受体数量: 6
氢键供体数量: 2
Smile: c1cc(ccc1CN(c2ccc(cc2)C(F)(F)F)c3nc(cs3)c4ccc(cc4)Cl)C(=O)NCCC(=O)O
InChi: InChI=1S/C27H21ClF3N3O3S/c28-21-9-5-18(6-10-21)23-16-38-26(33-23)34(22-11-7-20(8-12-22)27(29,30)31)15-17-1-3-19(4-2-17)25(37)32-14-13-24(35)36/h1-12,16H,13-15H2,(H,32,37)(H,35,36)
InChiKey: InChIKey=CTJDFSIKSQVUTF-UHFFFAOYSA-N

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