6-butyl-N-[(4-methylsulfonylphenyl)methyl]-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide

Systemtic Name: 6-butyl-N-[(4-methylsulfonylphenyl)methyl]-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide Openeye Name: 6-butyl-N-[(4-methylsulfonylphenyl)methyl]-2-oxo-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide CAS Name: 6-butyl-N-[(4-methylsulfonylphenyl)methyl]-2-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 6-butyl-N-[(4-methylsulfonylphenyl)methyl]-2-oxo-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide Traditional Name: 6-butyl-2-keto-N-(4-mesylbenzyl)-1-[3-(trifluoromethyl)phenyl]nicotinamide Formula: C25H25F3N2O4S MolecularWeight: 506.53721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C25H25F3N2O4S/c1-3-4-7-19-11-14-22(23(31)29-16-17-9-12-21(13-10-17)35(2,33)34)24(32)30(19)20-8-5-6-18(15-20)25(26,27)28/h5-6,8-15H,3-4,7,16H2,1-2H3,(H,29,31)