(E)-3-[5-bromanyl-2-(4-methylpiperazin-1-yl)phenyl]-1-[2-(4-methylpiperazin-1-yl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-3-[5-bromanyl-2-(4-methylpiperazin-1-yl)phenyl]-1-[2-(4-methylpiperazin-1-yl)phenyl]prop-2-en-1-one Openeye Name: (E)-3-[5-bromo-2-(4-methylpiperazin-1-yl)phenyl]-1-[2-(4-methylpiperazin-1-yl)phenyl]prop-2-en-1-one CAS Name: (E)-3-[5-bromo-2-(4-methyl-1-piperazinyl)phenyl]-1-[2-(4-methyl-1-piperazinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-[5-bromo-2-(4-methylpiperazin-1-yl)phenyl]-1-[2-(4-methylpiperazin-1-yl)phenyl]prop-2-en-1-one Traditional Name: (E)-3-[5-bromo-2-(4-methylpiperazino)phenyl]-1-[2-(4-methylpiperazino)phenyl]prop-2-en-1-one Formula: C25H31BrN4O MolecularWeight: 483.44384

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)Br)C=CC(=O)C3=CC=CC=C3N4CCN(CC4)C

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)Br)/C=C/C(=O)C3=CC=CC=C3N4CCN(CC4)C

InChI

InChI=1S/C25H31BrN4O/c1-27-11-15-29(16-12-27)23-9-8-21(26)19-20(23)7-10-25(31)22-5-3-4-6-24(22)30-17-13-28(2)14-18-30/h3-10,19H,11-18H2,1-2H3/b10-7+