2-(METHYLTHIO)-4AH-PYRROLO[2,3-D]PYRIMIDIN-4(7H)-ONE

CAS号
154757-99-0 ;1201784-89-5 ;67831-83-8
CCD编号
CCD01959435
分子式
C7 H7 N3 O S
分子量
181.218

基本信息

产品名称: 2-(METHYLTHIO)-4AH-PYRROLO[2,3-D]PYRIMIDIN-4(7H)-ONE
CAS: 154757-99-0 ;1201784-89-5 ;67831-83-8
英文同义词: 2-(METHYLTHIO)-4A,7-DIHYDRO-4H-PYRROLO[2,3-D]PYRIMIDIN-4-ONE ; 2-(METHYLTHIO)-4AH-PYRROLO[2,3-D]PYRIMIDIN-4(7H)-ONE ; 2-(METHYLTHIO)-7H-PYRROLO[2,3-D]PYRIMIDIN-4-OL ; 2-(METHYLSULFANYL)-4H,4AH,7H-PYRROLO[2,3-D]PYRIMIDIN-4-ONE
MDL号: MFCD12911736
氢键受体数量: 4
氢键供体数量: 1
Smile: CSC1=NC(=O)C2C=CNC2=N1
InChi: InChI=1S/C7H7N3OS/c1-12-7-9-5-4(2-3-8-5)6(11)10-7/h2-4H,1H3,(H,8,9,10,11)
InChiKey: InChIKey=TUIMYXLDKWBYTA-UHFFFAOYSA-N

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