5-methyl-4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1-phenethyl-pyrazole

Systemtic Name: 5-methyl-4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1-phenethyl-pyrazole Openeye Name: 5-methyl-3-(4-methylsulfonylphenyl)-1-phenethyl-4-(p-tolyl)pyrazole CAS Name: 5-methyl-4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1-phenethylpyrazole IUPAC Name: 5-methyl-4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1-phenethylpyrazole Traditional Name: 3-(4-mesylphenyl)-5-methyl-1-phenethyl-4-(p-tolyl)pyrazole Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)C)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)C)CCC4=CC=CC=C4)C

InChI

InChI=1S/C26H26N2O2S/c1-19-9-11-22(12-10-19)25-20(2)28(18-17-21-7-5-4-6-8-21)27-26(25)23-13-15-24(16-14-23)31(3,29)30/h4-16H,17-18H2,1-3H3