N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-[2-(1,4-oxazepan-4-yl)ethoxy]phenyl]-3-fluoranyl-4-(trifluoromethyl)benzamide

Systemtic Name: N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-[2-(1,4-oxazepan-4-yl)ethoxy]phenyl]-3-fluoranyl-4-(trifluoromethyl)benzamide Openeye Name: N-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-[2-(1,4-oxazepan-4-yl)ethoxy]phenyl]-3-fluoro-4-(trifluoromethyl)benzamide CAS Name: N-[3-(4-bromo-2-methyl-3-pyrazolyl)-4-[2-(1,4-oxazepan-4-yl)ethoxy]phenyl]-3-fluoro-4-(trifluoromethyl)benzamide IUPAC Name: N-[3-(4-bromo-2-methylpyrazol-3-yl)-4-[2-(1,4-oxazepan-4-yl)ethoxy]phenyl]-3-fluoro-4-(trifluoromethyl)benzamide Traditional Name: N-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-[2-(1,4-oxazepan-4-yl)ethoxy]phenyl]-3-fluoro-4-(trifluoromethyl)benzamide Formula: C25H25BrF4N4O3 MolecularWeight: 585.388613

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)C3=CC(=C(C=C3)C(F)(F)F)F)OCCN4CCCOCC4

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)C3=CC(=C(C=C3)C(F)(F)F)F)OCCN4CCCOCC4

InChI

InChI=1S/C25H25BrF4N4O3/c1-33-23(20(26)15-31-33)18-14-17(4-6-22(18)37-12-9-34-7-2-10-36-11-8-34)32-24(35)16-3-5-19(21(27)13-16)25(28,29)30/h3-6,13-15H,2,7-12H2,1H3,(H,32,35)