N-[2,5-bis(fluoranyl)phenyl]-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,5-bis(fluoranyl)phenyl]-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-(2,5-difluorophenyl)-2-(4-morpholinophthalazin-1-yl)sulfanyl-acetamide CAS Name: N-(2,5-difluorophenyl)-2-[[4-(4-morpholinyl)-1-phthalazinyl]thio]acetamide IUPAC Name: N-(2,5-difluorophenyl)-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-(2,5-difluorophenyl)-2-[(4-morpholinophthalazin-1-yl)thio]acetamide Formula: C20H18F2N4O2S MolecularWeight: 416.444326

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NN=C(C3=CC=CC=C32)SCC(=O)NC4=C(C=CC(=C4)F)F

Isomeric SMILES

C1COCCN1C2=NN=C(C3=CC=CC=C32)SCC(=O)NC4=C(C=CC(=C4)F)F

InChI

InChI=1S/C20H18F2N4O2S/c21-13-5-6-16(22)17(11-13)23-18(27)12-29-20-15-4-2-1-3-14(15)19(24-25-20)26-7-9-28-10-8-26/h1-6,11H,7-10,12H2,(H,23,27)