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

Systemtic Name: 6-methyl-2-oxidanylidene-N-[(4-piperazin-1-ylsulfonylphenyl)methyl]-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide Openeye Name: 6-methyl-2-oxo-N-[(4-piperazin-1-ylsulfonylphenyl)methyl]-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide CAS Name: 6-methyl-2-oxo-N-[[4-(1-piperazinylsulfonyl)phenyl]methyl]-1-[3-(trifluoromethyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 6-methyl-2-oxo-N-[(4-piperazin-1-ylsulfonylphenyl)methyl]-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide Traditional Name: 2-keto-6-methyl-N-(4-piperazinosulfonylbenzyl)-1-[3-(trifluoromethyl)phenyl]nicotinamide Formula: C25H25F3N4O4S MolecularWeight: 534.55061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCNCC4

Isomeric SMILES

CC1=CC=C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCNCC4

InChI

InChI=1S/C25H25F3N4O4S/c1-17-5-10-22(24(34)32(17)20-4-2-3-19(15-20)25(26,27)28)23(33)30-16-18-6-8-21(9-7-18)37(35,36)31-13-11-29-12-14-31/h2-10,15,29H,11-14,16H2,1H3,(H,30,33)