2-fluoranyl-6-[4-[(5-methyl-6-oxidanylidene-1-phenyl-2,5-dihydro-1,2,4-triazin-3-yl)carbonyl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-[(5-methyl-6-oxidanylidene-1-phenyl-2,5-dihydro-1,2,4-triazin-3-yl)carbonyl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-(5-methyl-6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carbonyl)piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-[(5-methyl-6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazin-3-yl)-oxomethyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-(5-methyl-6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carbonyl)piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-(6-keto-5-methyl-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carbonyl)piperazino]benzonitrile Formula: C22H21FN6O2 MolecularWeight: 420.439543

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(NC(=N1)C(=O)N2CCN(CC2)C3=C(C(=CC=C3)F)C#N)C4=CC=CC=C4

Isomeric SMILES

CC1C(=O)N(NC(=N1)C(=O)N2CCN(CC2)C3=C(C(=CC=C3)F)C#N)C4=CC=CC=C4

InChI

InChI=1S/C22H21FN6O2/c1-15-21(30)29(16-6-3-2-4-7-16)26-20(25-15)22(31)28-12-10-27(11-13-28)19-9-5-8-18(23)17(19)14-24/h2-9,15H,10-13H2,1H3,(H,25,26)