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2-[(4-methylsulfanylphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one

2-[(4-methylsulfanylphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one

Systemtic Name:2-[(4-methylsulfanylphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one
Openeye Name:2-[(4-methylsulfanylphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one
CAS Name:2-[[4-(methylthio)phenyl]methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one
IUPAC Name:2-[(4-methylsulfanylphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one
Traditional Name:1-[4-(methylthio)benzyl]-5-(trifluoromethyl)-3-pyrazolin-3-one
Formula: C12H11F3N2OS
MolecularWeight: 288.28875
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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2C(=CC(=O)N2)C(F)(F)F


Isomeric SMILES

CSC1=CC=C(C=C1)CN2C(=CC(=O)N2)C(F)(F)F


InChI

InChI=1S/C12H11F3N2OS/c1-19-9-4-2-8(3-5-9)7-17-10(12(13,14)15)6-11(18)16-17/h2-6H,7H2,1H3,(H,16,18)


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