N-(5-chloranylpyridin-2-yl)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-pyridyl)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-acetamide CAS Name: N-(5-chloro-2-pyridinyl)-2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]acetamide IUPAC Name: N-(5-chloropyridin-2-yl)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]acetamide Formula: C21H14ClFN4OS MolecularWeight: 424.878463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2SCC(=O)NC3=NC=C(C=C3)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2SCC(=O)NC3=NC=C(C=C3)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H14ClFN4OS/c22-14-7-10-18(24-11-14)25-19(28)12-29-21-17-4-2-1-3-16(17)20(26-27-21)13-5-8-15(23)9-6-13/h1-11H,12H2,(H,24,25,28)