2-[[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[4-(4-fluorophenyl)-1-phthalazinyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[4-(4-fluorophenyl)phthalazin-1-yl]thio]methyl]-1H-quinazolin-4-one Formula: C23H15FN4OS MolecularWeight: 414.454803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2SCC3=NC(=O)C4=CC=CC=C4N3)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2SCC3=NC(=O)C4=CC=CC=C4N3)C5=CC=C(C=C5)F

InChI

InChI=1S/C23H15FN4OS/c24-15-11-9-14(10-12-15)21-16-5-1-2-6-17(16)23(28-27-21)30-13-20-25-19-8-4-3-7-18(19)22(29)26-20/h1-12H,13H2,(H,25,26,29)