5-ethyl-8-fluoranyl-3-phenyl-1-(4-propan-2-ylpiperazin-1-yl)carbonyl-pyridazino[4,5-b]indol-4-one

Systemtic Name: 5-ethyl-8-fluoranyl-3-phenyl-1-(4-propan-2-ylpiperazin-1-yl)carbonyl-pyridazino[4,5-b]indol-4-one Openeye Name: 5-ethyl-8-fluoro-1-(4-isopropylpiperazine-1-carbonyl)-3-phenyl-pyridazino[4,5-b]indol-4-one CAS Name: 5-ethyl-8-fluoro-1-[oxo-(4-propan-2-yl-1-piperazinyl)methyl]-3-phenyl-4-pyridazino[4,5-b]indolone IUPAC Name: 5-ethyl-8-fluoro-3-phenyl-1-(4-propan-2-ylpiperazine-1-carbonyl)pyridazino[4,5-b]indol-4-one Traditional Name: 5-ethyl-8-fluoro-1-(4-isopropylpiperazine-1-carbonyl)-3-phenyl-pyridazin[4,5-b]indol-4-one Formula: C26H28FN5O2 MolecularWeight: 461.531223

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)F)C3=C1C(=O)N(N=C3C(=O)N4CCN(CC4)C(C)C)C5=CC=CC=C5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)F)C3=C1C(=O)N(N=C3C(=O)N4CCN(CC4)C(C)C)C5=CC=CC=C5

InChI

InChI=1S/C26H28FN5O2/c1-4-31-21-11-10-18(27)16-20(21)22-23(25(33)30-14-12-29(13-15-30)17(2)3)28-32(26(34)24(22)31)19-8-6-5-7-9-19/h5-11,16-17H,4,12-15H2,1-3H3