N-[2-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-fluoranyl-benzamide Openeye Name: N-[2-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-2-oxo-ethyl]-4-fluoro-benzamide CAS Name: N-[2-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-2-oxoethyl]-4-fluorobenzamide IUPAC Name: N-[2-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-2-oxoethyl]-4-fluorobenzamide Traditional Name: N-[2-[4-(5-bromopyrimidin-2-yl)piperazino]-2-keto-ethyl]-4-fluoro-benzamide Formula: C17H17BrFN5O2 MolecularWeight: 422.251583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)Br)C(=O)CNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)Br)C(=O)CNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H17BrFN5O2/c18-13-9-21-17(22-10-13)24-7-5-23(6-8-24)15(25)11-20-16(26)12-1-3-14(19)4-2-12/h1-4,9-10H,5-8,11H2,(H,20,26)