C9H10F2N6O2S structure

C9H10F2N6O2S

methyl 1-[[4-amino-5-(difluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyrazole-3-carboxylate

Also Known As: methyl 1-({[4-amino-5-(difluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H-pyrazole-3-carboxylate|methyl 1-[[4-amino-5-(difluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyrazole-3-carboxylate|methyl 1-(((4-amino-5-(difluoromethyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-pyrazole-3-carboxylate|1-(4-Amino-5-difluoromethyl-4H-[1,2,4]triazol-3-ylsulfanylmethyl)-1H-pyrazole-3-carboxylic acid methyl ester|1-(4-amino-5-difluoromethyl-4h-[1,2,4]triazol-3-ylsulfanylmethyl)-1h-pyrazole-3-carboxylic acid meth|methyl 1-(([4-amino-5-(difluoromethyl)-4h-1,2,4-triazol-3-yl]sulfanyl)methyl)-1h-pyrazole-3-carboxyl|METHYL 1-({[4-AMINO-5-(DIFLUOROMETHYL)-1,2,4-TRIAZOL-3-YL]SULFANYL}METHYL)PYRAZOLE-3-CARBOXYLATE|METHYL 1-({[4-AMINO-5-(DIFLUOROMETHYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}METHYL)-1H-PYRAZOLE-3-CARBOXYLATE|Methyl 1-({4-Amino-5-(difluoromethyl)-4H-1,2,4-triazol-3-ylthio}methyl)-1H-pyrazole-3-carboxylate|methyl 1-{[4-amino-5-(difluoromethyl)-1,2,4-triazol-3-ylthio]methyl}pyrazole-3 -carboxylate|methyl1-({[4-amino-5-(difluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H-pyrazole-3-carboxylate

CAS: 956440-79-2
Molecular Formula C9H10F2N6O2S
Molecular Weight 304.0554 g/mol
LogP 0.6624
Topological Polar Surface Area 100.85 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 304.0554
Monoisotopic Mass 304.0554
Heavy Atoms 20
Complexity 613.3547

Chemical Identifiers

CAS Number 956440-79-2
SMILES COC(=O)C1=NN(C=C1)CSC2=NN=C(N2N)C(F)F

Product Overview

C9H10F2N6O2S (CAS 956440-79-2), with molecular formula C9H10F2N6O2S and molecular weight 304.0554 g/mol. IUPAC: methyl 1-[[4-amino-5-(difluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyrazole-3-carboxylate.

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