573971-68-3
4-((4-(DIETHYLAMINO)BENZYLIDENE)AMINO)-5-(2-F-PHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL
Name4-((4-(DIETHYLAMINO)BENZYLIDENE)AMINO)-5-(2-F-PHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL
1Identification
【Name】
4-((4-(DIETHYLAMINO)BENZYLIDENE)AMINO)-5-(2-F-PHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL
【CAS】
【MDL】
MFCD04023048
【English Synonyms】
【Formula】
C19 H20 F N5 S
【MolWeight】
369.466
【Inchi】
InChI=1S/C19H20FN5S/c1-3-24(4-2)15-11-9-14(10-12-15)13-21-25-18(22-23-19(25)26)16-7-5-6-8-17(16)20/h5-13H,3-4H2,1-2H3,(H,23,26)/b21-13+
【InChIKey】
InChIKey=IDOGFLWNNKGIOQ-FYJGNVAPSA-N
【SMILES】
CCN(CC)c1ccc(cc1)/C=N/n2c(nnc2S)c3ccccc3F
【MOL File】
4-((4-(DIETHYLAMINO)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-((4-(DIETHYLAMINO)BENZYLIDENE)AMINO)-5-(2-F-PHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL.cml