[(7-HYDROXY-5-METHYL[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-2-YL)THIO]ACETIC ACID HYDRATE

CAS号
CCD编号
CCD02009214
分子式
C8 H8 N4 O3 S . H2 O
分子量
258.257

基本信息

产品名称: [(7-HYDROXY-5-METHYL[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-2-YL)THIO]ACETIC ACID HYDRATE
英文同义词: [(7-HYDROXY-5-METHYL[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-2-YL)THIO]ACETIC ACID HYDRATE
MDL号: MFCD13194071
氢键受体数量: 7
氢键供体数量: 2
Smile: Cc1cc(nc2n1nc(n2)SCC(=O)O)O.O
InChi: InChI=1S/C8H8N4O3S.H2O/c1-4-2-5(13)9-7-10-8(11-12(4)7)16-3-6(14)15;/h2H,3H2,1H3,(H,14,15)(H,9,10,11,13);1H2
InChiKey: InChIKey=VEWKTMJMSHJBHN-UHFFFAOYSA-N

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