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

Systemtic Name: N-[4-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]phenyl]-2-furamide Formula: C18H16N6O2 MolecularWeight: 348.35864

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)NCC3=CC=C(C=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)NCC3=CC=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C18H16N6O2/c1-24-17-14(10-22-24)16(20-11-21-17)19-9-12-4-6-13(7-5-12)23-18(25)15-3-2-8-26-15/h2-8,10-11H,9H2,1H3,(H,23,25)(H,19,20,21)