N-(3-nitro-5-pyridin-3-yloxy-phenyl)-7-thiophen-2-yl-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: N-(3-nitro-5-pyridin-3-yloxy-phenyl)-7-thiophen-2-yl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-[3-nitro-5-(3-pyridyloxy)phenyl]-7-(2-thienyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: N-[3-nitro-5-(3-pyridinyloxy)phenyl]-7-thiophen-2-yl-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-(3-nitro-5-pyridin-3-yloxyphenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: N-[3-nitro-5-(3-pyridyloxy)phenyl]-7-(2-thienyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C22H14N6O4S MolecularWeight: 458.44936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C4N=CC=C(N4N=C3)C5=CC=CS5

Isomeric SMILES

C1=CC(=CN=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C4N=CC=C(N4N=C3)C5=CC=CS5

InChI

InChI=1S/C22H14N6O4S/c29-22(18-13-25-27-19(5-7-24-21(18)27)20-4-2-8-33-20)26-14-9-15(28(30)31)11-17(10-14)32-16-3-1-6-23-12-16/h1-13H,(H,26,29)