8-[[4-fluoranyl-3-[[4-(1H-pyrazol-5-ylcarbonyl)-1,4-diazepan-1-yl]carbonyl]phenyl]methyl]-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one

Systemtic Name: 8-[[4-fluoranyl-3-[[4-(1H-pyrazol-5-ylcarbonyl)-1,4-diazepan-1-yl]carbonyl]phenyl]methyl]-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one Openeye Name: 8-[[4-fluoro-3-[4-(1H-pyrazole-5-carbonyl)-1,4-diazepane-1-carbonyl]phenyl]methyl]-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one CAS Name: 8-[[4-fluoro-3-[oxo-[4-[oxo(1H-pyrazol-5-yl)methyl]-1,4-diazepan-1-yl]methyl]phenyl]methyl]-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one IUPAC Name: 8-[[4-fluoro-3-[4-(1H-pyrazole-5-carbonyl)-1,4-diazepane-1-carbonyl]phenyl]methyl]-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one Traditional Name: 8-[4-fluoro-3-[4-(1H-pyrazole-5-carbonyl)-1,4-diazepane-1-carbonyl]benzyl]-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one Formula: C24H26FN7O3 MolecularWeight: 479.506743

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=NNC2=O)CC3=CC(=C(C=C3)F)C(=O)N4CCCN(CC4)C(=O)C5=CC=NN5)NC1

Isomeric SMILES

C1CC2=C(C(=NNC2=O)CC3=CC(=C(C=C3)F)C(=O)N4CCCN(CC4)C(=O)C5=CC=NN5)NC1

InChI

InChI=1S/C24H26FN7O3/c25-18-5-4-15(14-20-21-16(3-1-7-26-21)22(33)30-29-20)13-17(18)23(34)31-9-2-10-32(12-11-31)24(35)19-6-8-27-28-19/h4-6,8,13,26H,1-3,7,9-12,14H2,(H,27,28)(H,30,33)