577761-06-9
3-(2,4-DICHLOROPHENYL)-5-((4-FLUOROBENZYL)THIO)-4H-1,2,4-TRIAZOL-4-YLAMINE
Name3-(2,4-DICHLOROPHENYL)-5-((4-FLUOROBENZYL)THIO)-4H-1,2,4-TRIAZOL-4-YLAMINE
FormulaC15 H11 Cl2 F N4 S
1Identification
【Name】
3-(2,4-DICHLOROPHENYL)-5-((4-FLUOROBENZYL)THIO)-4H-1,2,4-TRIAZOL-4-YLAMINE
【CAS】
【MDL】
MFCD04018458
【English Synonyms】
【Formula】
C15 H11 Cl2 F N4 S
【MolWeight】
369.25
【Inchi】
InChI=1S/C15H11Cl2FN4S/c16-10-3-6-12(13(17)7-10)14-20-21-15(22(14)19)23-8-9-1-4-11(18)5-2-9/h1-7H,8,19H2
【InChIKey】
InChIKey=WIBKOLVSJZZYJZ-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1CSc2nnc(n2N)c3ccc(cc3Cl)Cl)F
【MOL File】
3-(2,4-DICHLOROPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(2,4-DICHLOROPHENYL)-5-((4-FLUOROBENZYL)THIO)-4H-1,2,4-TRIAZOL-4-YLAMINE.cml