1-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-4-oxidanylidene-3H-phthalazin-6-yl]-3-pyridin-3-yl-urea

Systemtic Name: 1-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-4-oxidanylidene-3H-phthalazin-6-yl]-3-pyridin-3-yl-urea Openeye Name: 1-[1-[(4-chloro-3-fluoro-phenyl)methyl]-4-oxo-3H-phthalazin-6-yl]-3-(3-pyridyl)urea CAS Name: 1-[1-[(4-chloro-3-fluorophenyl)methyl]-4-oxo-3H-phthalazin-6-yl]-3-(3-pyridinyl)urea IUPAC Name: 1-[1-[(4-chloro-3-fluorophenyl)methyl]-4-oxo-3H-phthalazin-6-yl]-3-pyridin-3-ylurea Traditional Name: 1-[1-(4-chloro-3-fluoro-benzyl)-4-keto-3H-phthalazin-6-yl]-3-(3-pyridyl)urea Formula: C21H15ClFN5O2 MolecularWeight: 423.827503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=O)NC2=CC3=C(C=C2)C(=NNC3=O)CC4=CC(=C(C=C4)Cl)F

Isomeric SMILES

C1=CC(=CN=C1)NC(=O)NC2=CC3=C(C=C2)C(=NNC3=O)CC4=CC(=C(C=C4)Cl)F

InChI

InChI=1S/C21H15ClFN5O2/c22-17-6-3-12(8-18(17)23)9-19-15-5-4-13(10-16(15)20(29)28-27-19)25-21(30)26-14-2-1-7-24-11-14/h1-8,10-11H,9H2,(H,28,29)(H2,25,26,30)