5-(4-chlorophenyl)-3-(4-methylsulfanylphenyl)-1-(4-methylsulfonylphenyl)pyrazole

Systemtic Name: 5-(4-chlorophenyl)-3-(4-methylsulfanylphenyl)-1-(4-methylsulfonylphenyl)pyrazole Openeye Name: 5-(4-chlorophenyl)-3-(4-methylsulfanylphenyl)-1-(4-methylsulfonylphenyl)pyrazole CAS Name: 5-(4-chlorophenyl)-1-(4-methylsulfonylphenyl)-3-[4-(methylthio)phenyl]pyrazole IUPAC Name: 5-(4-chlorophenyl)-3-(4-methylsulfanylphenyl)-1-(4-methylsulfonylphenyl)pyrazole Traditional Name: 5-(4-chlorophenyl)-1-(4-mesylphenyl)-3-[4-(methylthio)phenyl]pyrazole Formula: C23H19ClN2O2S2 MolecularWeight: 454.99216

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NN(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NN(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C23H19ClN2O2S2/c1-29-20-11-5-16(6-12-20)22-15-23(17-3-7-18(24)8-4-17)26(25-22)19-9-13-21(14-10-19)30(2,27)28/h3-15H,1-2H3