N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[4-[3,5-bis(trifluoromethyl)-1-pyrazolyl]phenyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-6-methylpyridine-3-carboxamide Traditional Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-6-methyl-nicotinamide Formula: C18H12F6N4O MolecularWeight: 414.304499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H12F6N4O/c1-10-2-3-11(9-25-10)16(29)26-12-4-6-13(7-5-12)28-15(18(22,23)24)8-14(27-28)17(19,20)21/h2-9H,1H3,(H,26,29)