4a-(4-fluorophenyl)-1-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-4,5,6,7-tetrahydro-3H-pyrimido[1,6-c]pyrimidin-8-one

Systemtic Name: 4a-(4-fluorophenyl)-1-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-4,5,6,7-tetrahydro-3H-pyrimido[1,6-c]pyrimidin-8-one Openeye Name: 4a-(4-fluorophenyl)-1-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]vinyl]-4,5,6,7-tetrahydro-3H-pyrimido[1,6-c]pyrimidin-8-one CAS Name: 4a-(4-fluorophenyl)-1-[(E)-2-[3-methoxy-4-(4-methyl-1-imidazolyl)phenyl]ethenyl]-4,5,6,7-tetrahydro-3H-pyrimido[1,6-c]pyrimidin-8-one IUPAC Name: 4a-(4-fluorophenyl)-1-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-4,5,6,7-tetrahydro-3H-pyrimido[1,6-c]pyrimidin-8-one Traditional Name: 4a-(4-fluorophenyl)-1-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]vinyl]-4,5,6,7-tetrahydro-3H-pyrimido[1,6-c]pyrimidin-8-one Formula: C26H26FN5O2 MolecularWeight: 459.515343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)C2=C(C=C(C=C2)C=CC3=NCCC4(N3C(=O)NCC4)C5=CC=C(C=C5)F)OC

Isomeric SMILES

CC1=CN(C=N1)C2=C(C=C(C=C2)/C=C/C3=NCCC4(N3C(=O)NCC4)C5=CC=C(C=C5)F)OC

InChI

InChI=1S/C26H26FN5O2/c1-18-16-31(17-30-18)22-9-3-19(15-23(22)34-2)4-10-24-28-13-11-26(12-14-29-25(33)32(24)26)20-5-7-21(27)8-6-20/h3-10,15-17H,11-14H2,1-2H3,(H,29,33)/b10-4+