2-[(E)-2-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]ethenyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(E)-2-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]ethenyl]-1H-quinazolin-4-one Openeye Name: 2-[(E)-2-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]vinyl]-1H-quinazolin-4-one CAS Name: 2-[(E)-2-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]ethenyl]-1H-quinazolin-4-one IUPAC Name: 2-[(E)-2-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]ethenyl]-1H-quinazolin-4-one Traditional Name: 2-[(E)-2-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]vinyl]-1H-quinazolin-4-one Formula: C27H18N4O2 MolecularWeight: 430.45742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)C=CC5=NC(=O)C6=CC=CC=C6N5

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)/C=C/C5=NC(=O)C6=CC=CC=C6N5

InChI

InChI=1S/C27H18N4O2/c32-27-21-11-5-6-12-22(21)28-25(29-27)15-14-19-17-31(20-9-2-1-3-10-20)30-26(19)24-16-18-8-4-7-13-23(18)33-24/h1-17H,(H,28,29,32)/b15-14+