2-[2-[3,5-bis(fluoranyl)phenyl]ethanoylamino]-N-(5-bromanylpyrazin-2-yl)pentanamide

Systemtic Name: 2-[2-[3,5-bis(fluoranyl)phenyl]ethanoylamino]-N-(5-bromanylpyrazin-2-yl)pentanamide Openeye Name: N-(5-bromopyrazin-2-yl)-2-[[2-(3,5-difluorophenyl)acetyl]amino]pentanamide CAS Name: N-(5-bromo-2-pyrazinyl)-2-[[2-(3,5-difluorophenyl)-1-oxoethyl]amino]pentanamide IUPAC Name: N-(5-bromopyrazin-2-yl)-2-[[2-(3,5-difluorophenyl)acetyl]amino]pentanamide Traditional Name: N-(5-bromopyrazin-2-yl)-2-[[2-(3,5-difluorophenyl)acetyl]amino]valeramide Formula: C17H17BrF2N4O2 MolecularWeight: 427.243286

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CN=C(C=N1)Br)NC(=O)CC2=CC(=CC(=C2)F)F

Isomeric SMILES

CCCC(C(=O)NC1=CN=C(C=N1)Br)NC(=O)CC2=CC(=CC(=C2)F)F

InChI

InChI=1S/C17H17BrF2N4O2/c1-2-3-13(17(26)24-15-9-21-14(18)8-22-15)23-16(25)6-10-4-11(19)7-12(20)5-10/h4-5,7-9,13H,2-3,6H2,1H3,(H,23,25)(H,22,24,26)