98213-64-0
6-METHYL-5-THIOXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZIN-3-ONE
Name6-METHYL-5-THIOXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZIN-3-ONE
1Identification
【Name】
6-METHYL-5-THIOXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZIN-3-ONE
【CAS】
【MDL】
MFCD00193146
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C4 H5 N3 O S
【pro_molWeight】
143.169
【Inchi】
InChI=1S/C4H5N3OS/c1-2-3(9)5-4(8)7-6-2/h1H3,(H2,5,7,8,9)
【InChIKey】
InChIKey=FGZQRZAHVJVJGF-UHFFFAOYSA-N
【SMILES】
Cc1c(=S)[nH]c(=O)[nH]n1
【MOL File】
6-METHYL-5-THIOXO-2,….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:4
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
6-METHYL-5-THIOXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZIN-3-ONE.cml