1-(4-methylsulfanylphenyl)-5-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 1-(4-methylsulfanylphenyl)-5-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 1-(4-methylsulfanylphenyl)-5-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole CAS Name: 1-[4-(methylthio)phenyl]-5-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 1-(4-methylsulfanylphenyl)-5-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 1-[4-(methylthio)phenyl]-5-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Formula: C17H12F3N3O2S MolecularWeight: 379.35629

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12F3N3O2S/c1-26-14-8-6-12(7-9-14)22-15(10-16(21-22)17(18,19)20)11-2-4-13(5-3-11)23(24)25/h2-10H,1H3