5-(4-methylsulfonylphenyl)-1,4-bis(4-methylthiophen-2-yl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 5-(4-methylsulfonylphenyl)-1,4-bis(4-methylthiophen-2-yl)-3-(trifluoromethyl)pyrazole Openeye Name: 5-(4-methylsulfonylphenyl)-1,4-bis(4-methyl-2-thienyl)-3-(trifluoromethyl)pyrazole CAS Name: 5-(4-methylsulfonylphenyl)-1,4-bis(4-methyl-2-thiophenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 5-(4-methylsulfonylphenyl)-1,4-bis(4-methylthiophen-2-yl)-3-(trifluoromethyl)pyrazole Traditional Name: 5-(4-mesylphenyl)-1,4-bis(4-methyl-2-thienyl)-3-(trifluoromethyl)pyrazole Formula: C21H17F3N2O2S3 MolecularWeight: 482.56209

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=C(N(N=C2C(F)(F)F)C3=CC(=CS3)C)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CSC(=C1)C2=C(N(N=C2C(F)(F)F)C3=CC(=CS3)C)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C21H17F3N2O2S3/c1-12-8-16(29-10-12)18-19(14-4-6-15(7-5-14)31(3,27)28)26(17-9-13(2)11-30-17)25-20(18)21(22,23)24/h4-11H,1-3H3