2-[4-(3-bromanyl-5-fluoranyl-phenyl)carbonylpiperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[4-(3-bromanyl-5-fluoranyl-phenyl)carbonylpiperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[4-(3-bromo-5-fluoro-benzoyl)piperazin-1-yl]-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[4-[(3-bromo-5-fluorophenyl)-oxomethyl]-1-piperazinyl]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[4-(3-bromo-5-fluorobenzoyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[4-(3-bromo-5-fluoro-benzoyl)piperazino]-N-(5-methylisoxazol-3-yl)acetamide Formula: C17H18BrFN4O3 MolecularWeight: 425.252223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CN2CCN(CC2)C(=O)C3=CC(=CC(=C3)Br)F

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CN2CCN(CC2)C(=O)C3=CC(=CC(=C3)Br)F

InChI

InChI=1S/C17H18BrFN4O3/c1-11-6-15(21-26-11)20-16(24)10-22-2-4-23(5-3-22)17(25)12-7-13(18)9-14(19)8-12/h6-9H,2-5,10H2,1H3,(H,20,21,24)