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

Systemtic Name: 1,4-bis(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 1,4-bis(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 5-(4-methylsulfonylphenyl)-1,4-bis[4-(methylthio)phenyl]-3-(trifluoromethyl)pyrazole IUPAC Name: 1,4-bis(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 5-(4-mesylphenyl)-1,4-bis[4-(methylthio)phenyl]-3-(trifluoromethyl)pyrazole Formula: C25H21F3N2O2S3 MolecularWeight: 534.63665

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(N(N=C2C(F)(F)F)C3=CC=C(C=C3)SC)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(N(N=C2C(F)(F)F)C3=CC=C(C=C3)SC)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C25H21F3N2O2S3/c1-33-19-10-4-16(5-11-19)22-23(17-6-14-21(15-7-17)35(3,31)32)30(29-24(22)25(26,27)28)18-8-12-20(34-2)13-9-18/h4-15H,1-3H3