500878-13-7
N,3-DIMETHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOTHIOAMIDE
NameN,3-DIMETHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOTHIOAMIDE
1Identification
【Name】
N,3-DIMETHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOTHIOAMIDE
【CAS】
【MDL】
MFCD20228810
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C6 H9 N3 O S
【pro_molWeight】
171.223
【Inchi】
InChI=1S/C6H9N3OS/c1-4-3-5(10)9(8-4)6(11)7-2/h3H2,1-2H3,(H,7,11)
【InChIKey】
InChIKey=UQVKERAQSMORRI-UHFFFAOYSA-N
【SMILES】
CC1=NN(C(=O)C1)C(=S)NC
【MOL File】
N,3-DIMETHYL-5-OXO-4….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:4
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
N,3-DIMETHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOTHIOAMIDE.cml