N-[(3-METHYL-1H-PYRAZOL-4-YL)METHYL]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-4-AMINE

CAS号
CCD编号
CCD03398635
分子式
C13 H17 N3 S
分子量
247.364

基本信息

产品名称: N-[(3-METHYL-1H-PYRAZOL-4-YL)METHYL]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-4-AMINE
英文同义词: N-[(3-METHYL-1H-PYRAZOL-4-YL)METHYL]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-4-AMINE
MDL号: MFCD17132718
氢键受体数量: 3
氢键供体数量: 2
Smile: Cc1c(c[nH]n1)CNC2CCCc3c2ccs3
InChi: InChI=1S/C13H17N3S/c1-9-10(8-15-16-9)7-14-12-3-2-4-13-11(12)5-6-17-13/h5-6,8,12,14H,2-4,7H2,1H3,(H,15,16)
InChiKey: InChIKey=OTKLVMKSWSJTLO-UHFFFAOYSA-N

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