2-[3-[[2-(2-fluorophenyl)-1,3-thiazol-4-yl]methyl]-4-oxidanylidene-phthalazin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[[2-(2-fluorophenyl)-1,3-thiazol-4-yl]methyl]-4-oxidanylidene-phthalazin-1-yl]ethanoic acid Openeye Name: 2-[3-[[2-(2-fluorophenyl)thiazol-4-yl]methyl]-4-oxo-phthalazin-1-yl]acetic acid CAS Name: 2-[3-[[2-(2-fluorophenyl)-4-thiazolyl]methyl]-4-oxo-1-phthalazinyl]acetic acid IUPAC Name: 2-[3-[[2-(2-fluorophenyl)-1,3-thiazol-4-yl]methyl]-4-oxophthalazin-1-yl]acetic acid Traditional Name: 2-[3-[[2-(2-fluorophenyl)thiazol-4-yl]methyl]-4-keto-phthalazin-1-yl]acetic acid Formula: C20H14FN3O3S MolecularWeight: 395.406863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CSC(=N3)C4=CC=CC=C4F)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CSC(=N3)C4=CC=CC=C4F)CC(=O)O

InChI

InChI=1S/C20H14FN3O3S/c21-16-8-4-3-7-15(16)19-22-12(11-28-19)10-24-20(27)14-6-2-1-5-13(14)17(23-24)9-18(25)26/h1-8,11H,9-10H2,(H,25,26)