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4-methoxy-5-(4-methylsulfanylphenyl)-2-[2,2,2-tris(fluoranyl)ethyl]pyridazin-3-one

4-methoxy-5-(4-methylsulfanylphenyl)-2-[2,2,2-tris(fluoranyl)ethyl]pyridazin-3-one

Systemtic Name:4-methoxy-5-(4-methylsulfanylphenyl)-2-[2,2,2-tris(fluoranyl)ethyl]pyridazin-3-one
Openeye Name:4-methoxy-5-(4-methylsulfanylphenyl)-2-(2,2,2-trifluoroethyl)pyridazin-3-one
CAS Name:4-methoxy-5-[4-(methylthio)phenyl]-2-(2,2,2-trifluoroethyl)-3-pyridazinone
IUPAC Name:4-methoxy-5-(4-methylsulfanylphenyl)-2-(2,2,2-trifluoroethyl)pyridazin-3-one
Traditional Name:4-methoxy-5-[4-(methylthio)phenyl]-2-(2,2,2-trifluoroethyl)pyridazin-3-one
Formula: C14H13F3N2O2S
MolecularWeight: 330.32543
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=NN(C1=O)CC(F)(F)F)C2=CC=C(C=C2)SC


Isomeric SMILES

COC1=C(C=NN(C1=O)CC(F)(F)F)C2=CC=C(C=C2)SC


InChI

InChI=1S/C14H13F3N2O2S/c1-21-12-11(9-3-5-10(22-2)6-4-9)7-18-19(13(12)20)8-14(15,16)17/h3-7H,8H2,1-2H3


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