4-[4-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-[4-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]carbonyl-2H-phthalazin-1-one Openeye Name: 4-[4-[[2-(4-fluorophenyl)thiazol-4-yl]methyl]piperazine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[[4-[[2-(4-fluorophenyl)-4-thiazolyl]methyl]-1-piperazinyl]-oxomethyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]piperazine-1-carbonyl]-2H-phthalazin-1-one Traditional Name: 4-[4-[[2-(4-fluorophenyl)thiazol-4-yl]methyl]piperazine-1-carbonyl]-2H-phthalazin-1-one Formula: C23H20FN5O2S MolecularWeight: 449.500603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC(=N2)C3=CC=C(C=C3)F)C(=O)C4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CC2=CSC(=N2)C3=CC=C(C=C3)F)C(=O)C4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C23H20FN5O2S/c24-16-7-5-15(6-8-16)22-25-17(14-32-22)13-28-9-11-29(12-10-28)23(31)20-18-3-1-2-4-19(18)21(30)27-26-20/h1-8,14H,9-13H2,(H,27,30)