3-[[2,2-bis(fluoranyl)-2-phenyl-ethyl]amino]-1-(3-bromanylpropyl)-6-methyl-pyrazin-2-one

Systemtic Name: 3-[[2,2-bis(fluoranyl)-2-phenyl-ethyl]amino]-1-(3-bromanylpropyl)-6-methyl-pyrazin-2-one Openeye Name: 1-(3-bromopropyl)-3-[(2,2-difluoro-2-phenyl-ethyl)amino]-6-methyl-pyrazin-2-one CAS Name: 1-(3-bromopropyl)-3-[(2,2-difluoro-2-phenylethyl)amino]-6-methyl-2-pyrazinone IUPAC Name: 1-(3-bromopropyl)-3-[(2,2-difluoro-2-phenylethyl)amino]-6-methylpyrazin-2-one Traditional Name: 1-(3-bromopropyl)-3-[(2,2-difluoro-2-phenyl-ethyl)amino]-6-methyl-pyrazin-2-one Formula: C16H18BrF2N3O MolecularWeight: 386.234426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=O)N1CCCBr)NCC(C2=CC=CC=C2)(F)F

Isomeric SMILES

CC1=CN=C(C(=O)N1CCCBr)NCC(C2=CC=CC=C2)(F)F

InChI

InChI=1S/C16H18BrF2N3O/c1-12-10-20-14(15(23)22(12)9-5-8-17)21-11-16(18,19)13-6-3-2-4-7-13/h2-4,6-7,10H,5,8-9,11H2,1H3,(H,20,21)