2-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(2,4-dimethyl-5-phenyl-7-imidazo[1,5-b]pyridazinyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(2,4-dimethyl-5-phenylimidazo[1,5-b]pyridazin-7-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)thio]methyl]-1H-quinazolin-4-one Formula: C23H19N5OS MolecularWeight: 413.49486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN2C1=C(N=C2SCC3=NC(=O)C4=CC=CC=C4N3)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=NN2C1=C(N=C2SCC3=NC(=O)C4=CC=CC=C4N3)C5=CC=CC=C5)C

InChI

InChI=1S/C23H19N5OS/c1-14-12-15(2)27-28-21(14)20(16-8-4-3-5-9-16)26-23(28)30-13-19-24-18-11-7-6-10-17(18)22(29)25-19/h3-12H,13H2,1-2H3,(H,24,25,29)