5-(3-fluoranyl-4-methoxy-phenyl)-1-(4-methylsulfanylphenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 5-(3-fluoranyl-4-methoxy-phenyl)-1-(4-methylsulfanylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 5-(3-fluoro-4-methoxy-phenyl)-1-(4-methylsulfanylphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 5-(3-fluoro-4-methoxyphenyl)-1-[4-(methylthio)phenyl]-3-(trifluoromethyl)pyrazole IUPAC Name: 5-(3-fluoro-4-methoxyphenyl)-1-(4-methylsulfanylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 5-(3-fluoro-4-methoxy-phenyl)-1-[4-(methylthio)phenyl]-3-(trifluoromethyl)pyrazole Formula: C18H14F4N2OS MolecularWeight: 382.375173

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)SC)C(F)(F)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)SC)C(F)(F)F)F

InChI

InChI=1S/C18H14F4N2OS/c1-25-16-8-3-11(9-14(16)19)15-10-17(18(20,21)22)23-24(15)12-4-6-13(26-2)7-5-12/h3-10H,1-2H3