4-(4-methylsulfonylphenyl)-1-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 4-(4-methylsulfonylphenyl)-1-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 4-(4-methylsulfonylphenyl)-1-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole CAS Name: 4-(4-methylsulfonylphenyl)-1-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 4-(4-methylsulfonylphenyl)-1-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 4-(4-mesylphenyl)-1-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Formula: C17H12F3N3O4S MolecularWeight: 411.35509

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CN(N=C2C(F)(F)F)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CN(N=C2C(F)(F)F)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12F3N3O4S/c1-28(26,27)14-8-2-11(3-9-14)15-10-22(21-16(15)17(18,19)20)12-4-6-13(7-5-12)23(24)25/h2-10H,1H3