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

Systemtic Name: N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-[2-(4-methoxypiperidin-1-yl)ethoxy]phenyl]-3-fluoranyl-benzamide Openeye Name: N-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-[2-(4-methoxy-1-piperidyl)ethoxy]phenyl]-3-fluoro-benzamide CAS Name: N-[3-(4-bromo-2-methyl-3-pyrazolyl)-4-[2-(4-methoxy-1-piperidinyl)ethoxy]phenyl]-3-fluorobenzamide IUPAC Name: N-[3-(4-bromo-2-methylpyrazol-3-yl)-4-[2-(4-methoxypiperidin-1-yl)ethoxy]phenyl]-3-fluorobenzamide Traditional Name: N-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-[2-(4-methoxypiperidino)ethoxy]phenyl]-3-fluoro-benzamide Formula: C25H28BrFN4O3 MolecularWeight: 531.417223

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)C3=CC(=CC=C3)F)OCCN4CCC(CC4)OC

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)C3=CC(=CC=C3)F)OCCN4CCC(CC4)OC

InChI

InChI=1S/C25H28BrFN4O3/c1-30-24(22(26)16-28-30)21-15-19(29-25(32)17-4-3-5-18(27)14-17)6-7-23(21)34-13-12-31-10-8-20(33-2)9-11-31/h3-7,14-16,20H,8-13H2,1-2H3,(H,29,32)