338779-11-6
2-(ALLYLSULFANYL)-3-METHYLTHIENO[3,2-D]PYRIMIDIN-4(3H)-ONE
Name2-(ALLYLSULFANYL)-3-METHYLTHIENO[3,2-D]PYRIMIDIN-4(3H)-ONE
1Identification
【Name】
2-(ALLYLSULFANYL)-3-METHYLTHIENO[3,2-D]PYRIMIDIN-4(3H)-ONE
【CAS】
【MDL】
MFCD00140025
【English Synonyms】
【Formula】
C10 H10 N2 O S2
【MolWeight】
238.334
【Inchi】
InChI=1S/C10H10N2OS2/c1-3-5-15-10-11-7-4-6-14-8(7)9(13)12(10)2/h3-4,6H,1,5H2,2H3
【InChIKey】
InChIKey=NBFOZYPAUNYOHS-UHFFFAOYSA-N
【SMILES】
Cn1c(=O)c2c(ccs2)nc1SCC=C
【MOL File】
2-(ALLYLSULFANYL)-3-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(ALLYLSULFANYL)-3-METHYLTHIENO[3,2-D]PYRIMIDIN-4(3H)-ONE.cml