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

Systemtic Name: 7-chloranyl-2-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[(2,4-dimethyl-5-phenyl-7-imidazo[1,5-b]pyridazinyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[(2,4-dimethyl-5-phenylimidazo[1,5-b]pyridazin-7-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)thio]methyl]-1H-quinazolin-4-one Formula: C23H18ClN5OS MolecularWeight: 447.93992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN2C1=C(N=C2SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=NN2C1=C(N=C2SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl)C5=CC=CC=C5)C

InChI

InChI=1S/C23H18ClN5OS/c1-13-10-14(2)28-29-21(13)20(15-6-4-3-5-7-15)27-23(29)31-12-19-25-18-11-16(24)8-9-17(18)22(30)26-19/h3-11H,12H2,1-2H3,(H,25,26,30)