4-[4-(4-methylsulfonylphenyl)-1-phenethyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine

Systemtic Name: 4-[4-(4-methylsulfonylphenyl)-1-phenethyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine Openeye Name: 4-[4-(4-methylsulfonylphenyl)-1-phenethyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine CAS Name: 4-[4-(4-methylsulfonylphenyl)-1-phenethyl-5-(trifluoromethyl)-3-pyrazolyl]pyridine IUPAC Name: 4-[4-(4-methylsulfonylphenyl)-1-phenethyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine Traditional Name: 4-[4-(4-mesylphenyl)-1-phenethyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine Formula: C24H20F3N3O2S MolecularWeight: 471.49471

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=NC=C3)CCC4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=NC=C3)CCC4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C24H20F3N3O2S/c1-33(31,32)20-9-7-18(8-10-20)21-22(19-11-14-28-15-12-19)29-30(23(21)24(25,26)27)16-13-17-5-3-2-4-6-17/h2-12,14-15H,13,16H2,1H3