(E)-3-(5-bromanyl-2-fluoranyl-phenyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(5-bromanyl-2-fluoranyl-phenyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(5-bromo-2-fluoro-phenyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-1-[4-(2-pyrazinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(5-bromo-2-fluorophenyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)-1-(4-pyrazin-2-ylpiperazino)prop-2-en-1-one Formula: C17H16BrFN4O MolecularWeight: 391.237543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2)C(=O)C=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)C(=O)/C=C/C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C17H16BrFN4O/c18-14-2-3-15(19)13(11-14)1-4-17(24)23-9-7-22(8-10-23)16-12-20-5-6-21-16/h1-6,11-12H,7-10H2/b4-1+