110623-26-2
2,4-DIHYDRO-5-(4-CHLOROPHENYL)-4-ETHYL-2-METHYL-3H-1,2,4-TRIAZOLE-3-THIONE
Name2,4-DIHYDRO-5-(4-CHLOROPHENYL)-4-ETHYL-2-METHYL-3H-1,2,4-TRIAZOLE-3-THIONE
pro_formulaC11 H12 Cl N3 S
1Identification
【Name】
2,4-DIHYDRO-5-(4-CHLOROPHENYL)-4-ETHYL-2-METHYL-3H-1,2,4-TRIAZOLE-3-THIONE
【CAS】
【MDL】
MFCD01761097
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C11 H12 Cl N3 S
【pro_molWeight】
253.756
【Inchi】
InChI=1S/C11H12ClN3S/c1-3-15-10(13-14(2)11(15)16)8-4-6-9(12)7-5-8/h4-7H,3H2,1-2H3
【InChIKey】
InChIKey=LDFDANAPKSZENI-UHFFFAOYSA-N
【SMILES】
CCn1c(nn(c1=S)C)c2ccc(cc2)Cl
【MOL File】
2,4-DIHYDRO-5-(4-CHL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2,4-DIHYDRO-5-(4-CHLOROPHENYL)-4-ETHYL-2-METHYL-3H-1,2,4-TRIAZOLE-3-THIONE.cml