2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-3-(2-methoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-3-(2-methoxyphenyl)quinazolin-4-one Openeye Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-3-(2-methoxyphenyl)quinazolin-4-one CAS Name: 2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]-3-(2-methoxyphenyl)-4-quinazolinone IUPAC Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-3-(2-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]-3-(2-methoxyphenyl)quinazolin-4-one Formula: C29H19FN4O2S MolecularWeight: 506.550163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC4=NN=C(C5=CC=CC=C54)C6=CC=C(C=C6)F

Isomeric SMILES

COC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC4=NN=C(C5=CC=CC=C54)C6=CC=C(C=C6)F

InChI

InChI=1S/C29H19FN4O2S/c1-36-25-13-7-6-12-24(25)34-28(35)22-10-4-5-11-23(22)31-29(34)37-27-21-9-3-2-8-20(21)26(32-33-27)18-14-16-19(30)17-15-18/h2-17H,1H3