2-fluoranyl-N-[(E)-[3-methyl-2-(4-phenylpiperazin-1-yl)carbonyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzamide

Systemtic Name: 2-fluoranyl-N-[(E)-[3-methyl-2-(4-phenylpiperazin-1-yl)carbonyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzamide Openeye Name: 2-fluoro-N-[(E)-[3-methyl-2-(4-phenylpiperazine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzamide CAS Name: 2-fluoro-N-[(E)-[3-methyl-2-[oxo-(4-phenyl-1-piperazinyl)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzamide IUPAC Name: 2-fluoro-N-[(E)-[3-methyl-2-(4-phenylpiperazine-1-carbonyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzamide Traditional Name: 2-fluoro-N-[(E)-[3-methyl-2-(4-phenylpiperazine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzamide Formula: C27H27FN4O3 MolecularWeight: 474.526683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=CC=C3F)CCC2)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=CC=C3F)/CCC2)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H27FN4O3/c1-18-24-22(29-30-26(33)20-10-5-6-11-21(20)28)12-7-13-23(24)35-25(18)27(34)32-16-14-31(15-17-32)19-8-3-2-4-9-19/h2-6,8-11H,7,12-17H2,1H3,(H,30,33)/b29-22+