N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-5-nitro-furan-2-carboxamide CAS Name: N-[5-methyl-2-(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-3-pyrazolyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-5-nitro-2-furamide Formula: C20H14N8O4 MolecularWeight: 430.37636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C20H14N8O4/c1-12-9-16(24-20(29)15-7-8-17(32-15)28(30)31)27(25-12)19-14-10-23-26(18(14)21-11-22-19)13-5-3-2-4-6-13/h2-11H,1H3,(H,24,29)