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

Systemtic Name: 3-bromanyl-N-[1-(3-chlorophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]benzamide Openeye Name: 3-bromo-N-[1-(3-chlorophenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]benzamide CAS Name: 3-bromo-N-[1-(3-chlorophenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]benzamide IUPAC Name: 3-bromo-N-[1-(3-chlorophenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]benzamide Traditional Name: 3-bromo-N-[1-(3-chlorophenyl)-4-keto-pyrazolo[3,4-d]pyrimidin-5-yl]benzamide Formula: C18H11BrClN5O2 MolecularWeight: 444.66924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)NN2C=NC3=C(C2=O)C=NN3C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)NN2C=NC3=C(C2=O)C=NN3C4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H11BrClN5O2/c19-12-4-1-3-11(7-12)17(26)23-24-10-21-16-15(18(24)27)9-22-25(16)14-6-2-5-13(20)8-14/h1-10H,(H,23,26)