5-(4-methylsulfonylphenyl)-1,4-bis(4-nitrophenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 5-(4-methylsulfonylphenyl)-1,4-bis(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 5-(4-methylsulfonylphenyl)-1,4-bis(4-nitrophenyl)-3-(trifluoromethyl)pyrazole CAS Name: 5-(4-methylsulfonylphenyl)-1,4-bis(4-nitrophenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 5-(4-methylsulfonylphenyl)-1,4-bis(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 5-(4-mesylphenyl)-1,4-bis(4-nitrophenyl)-3-(trifluoromethyl)pyrazole Formula: C23H15F3N4O6S MolecularWeight: 532.44861

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H15F3N4O6S/c1-37(35,36)19-12-4-15(5-13-19)21-20(14-2-6-17(7-3-14)29(31)32)22(23(24,25)26)27-28(21)16-8-10-18(11-9-16)30(33)34/h2-13H,1H3