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

Systemtic Name: 5-(4-methylsulfanylphenyl)-1-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 5-(4-methylsulfanylphenyl)-1-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole CAS Name: 5-[4-(methylthio)phenyl]-1-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 5-(4-methylsulfanylphenyl)-1-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 5-[4-(methylthio)phenyl]-1-(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)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

InChI

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