N-[4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]phenyl]furan-2-carboxamide CAS Name: N-[4-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]phenyl]-2-furamide Formula: C22H16N6O2 MolecularWeight: 396.40144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NC4=CC=C(C=C4)NC(=O)C5=CC=CO5

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NC4=CC=C(C=C4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C22H16N6O2/c29-22(19-7-4-12-30-19)27-16-10-8-15(9-11-16)26-20-18-13-25-28(21(18)24-14-23-20)17-5-2-1-3-6-17/h1-14H,(H,27,29)(H,23,24,26)