1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanyl-ethanone

Systemtic Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanyl-ethanone Openeye Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-morpholinophthalazin-1-yl)sulfanyl-ethanone CAS Name: 1-[4-(4-fluorophenyl)-1-piperazinyl]-2-[[4-(4-morpholinyl)-1-phthalazinyl]thio]ethanone IUPAC Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanylethanone Traditional Name: 1-[4-(4-fluorophenyl)piperazino]-2-[(4-morpholinophthalazin-1-yl)thio]ethanone Formula: C24H26FN5O2S MolecularWeight: 467.558943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CSC3=NN=C(C4=CC=CC=C43)N5CCOCC5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CSC3=NN=C(C4=CC=CC=C43)N5CCOCC5

InChI

InChI=1S/C24H26FN5O2S/c25-18-5-7-19(8-6-18)28-9-11-29(12-10-28)22(31)17-33-24-21-4-2-1-3-20(21)23(26-27-24)30-13-15-32-16-14-30/h1-8H,9-17H2