2-[6-azanyl-4-(furan-2-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[6-azanyl-4-(furan-2-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-1-ium-1-yl]ethanamide Openeye Name: 2-[6-amino-4-(2-furyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-1-ium-1-yl]acetamide CAS Name: 2-[6-amino-4-(2-furanyl)-1-phenyl-1-pyrazolo[3,4-d]pyrimidin-1-iumyl]acetamide IUPAC Name: 2-[6-amino-4-(furan-2-yl)-1-phenylpyrazolo[3,4-d]pyrimidin-1-ium-1-yl]acetamide Traditional Name: 2-[6-amino-4-(2-furyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-1-ium-1-yl]acetamide Formula: C17H15N6O2+ MolecularWeight: 335.34

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2(C3=NC(=NC(=C3C=N2)C4=CC=CO4)N)CC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)[N+]2(C3=NC(=NC(=C3C=N2)C4=CC=CO4)N)CC(=O)N

InChI

InChI=1S/C17H14N6O2/c18-14(24)10-23(11-5-2-1-3-6-11)16-12(9-20-23)15(21-17(19)22-16)13-7-4-8-25-13/h1-9H,10H2,(H3-,18,19,20,21,22,24)/p+1