5-bromanyl-2-chloranyl-N-[1-(4-fluorophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-[1-(4-fluorophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]benzamide Openeye Name: 5-bromo-2-chloro-N-[1-(4-fluorophenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]benzamide CAS Name: 5-bromo-2-chloro-N-[1-(4-fluorophenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]benzamide IUPAC Name: 5-bromo-2-chloro-N-[1-(4-fluorophenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]benzamide Traditional Name: 5-bromo-2-chloro-N-[1-(4-fluorophenyl)-4-keto-pyrazolo[3,4-d]pyrimidin-5-yl]benzamide Formula: C18H10BrClFN5O2 MolecularWeight: 462.659703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C3=C(C=N2)C(=O)N(C=N3)NC(=O)C4=C(C=CC(=C4)Br)Cl)F

Isomeric SMILES

C1=CC(=CC=C1N2C3=C(C=N2)C(=O)N(C=N3)NC(=O)C4=C(C=CC(=C4)Br)Cl)F

InChI

InChI=1S/C18H10BrClFN5O2/c19-10-1-6-15(20)13(7-10)17(27)24-25-9-22-16-14(18(25)28)8-23-26(16)12-4-2-11(21)3-5-12/h1-9H,(H,24,27)