N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-N-prop-2-ynyl-ethanamide

Systemtic Name: N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-N-prop-2-ynyl-ethanamide Openeye Name: N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-N-prop-2-ynyl-acetamide CAS Name: N-[3-(3-nitro-7-pyrazolo[1,5-a]pyrimidinyl)phenyl]-N-prop-2-ynylacetamide IUPAC Name: N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-N-prop-2-ynylacetamide Traditional Name: N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-N-propargyl-acetamide Formula: C17H13N5O3 MolecularWeight: 335.31682

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC#C)C1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N(CC#C)C1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O3/c1-3-9-20(12(2)23)14-6-4-5-13(10-14)15-7-8-18-17-16(22(24)25)11-19-21(15)17/h1,4-8,10-11H,9H2,2H3