6-butoxy-3-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-2-(trifluoromethyl)pyridine

Systemtic Name: 6-butoxy-3-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-2-(trifluoromethyl)pyridine Openeye Name: 6-butoxy-3-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-2-(trifluoromethyl)pyridine CAS Name: 6-butoxy-3-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-2-(trifluoromethyl)pyridine IUPAC Name: 6-butoxy-3-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-2-(trifluoromethyl)pyridine Traditional Name: 6-butoxy-3-(4-fluorophenyl)-4-(4-mesylphenyl)-2-(trifluoromethyl)pyridine Formula: C23H21F4NO3S MolecularWeight: 467.476353

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC(=C(C(=C1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F)C(F)(F)F

Isomeric SMILES

CCCCOC1=NC(=C(C(=C1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C23H21F4NO3S/c1-3-4-13-31-20-14-19(15-7-11-18(12-8-15)32(2,29)30)21(22(28-20)23(25,26)27)16-5-9-17(24)10-6-16/h5-12,14H,3-4,13H2,1-2H3