7-BENZYL-5-OXO-4,5-DIHYDROTHIENO[3,2-B]PYRIDINE-3-CARBOXYLIC ACID

CAS号
1251033-18-7
CCD编号
CCD03257234
分子式
C15 H11 N O3 S
分子量
285.322

基本信息

产品名称: 7-BENZYL-5-OXO-4,5-DIHYDROTHIENO[3,2-B]PYRIDINE-3-CARBOXYLIC ACID
CAS: 1251033-18-7
英文同义词: 7-BENZYL-5-OXO-4,5-DIHYDROTHIENO[3,2-B]PYRIDINE-3-CARBOXYLIC ACID
MDL号: MFCD16877228
氢键受体数量: 4
氢键供体数量: 2
Smile: c1ccc(cc1)Cc2cc(=O)[nH]c3c2scc3C(=O)O
InChi: InChI=1S/C15H11NO3S/c17-12-7-10(6-9-4-2-1-3-5-9)14-13(16-12)11(8-20-14)15(18)19/h1-5,7-8H,6H2,(H,16,17)(H,18,19)
InChiKey: InChIKey=JHRJFRWPFTVTKU-UHFFFAOYSA-N

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